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2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE is a chemical compound with the molecular formula C18H17ClNO. It is a derivative of acetamide and contains a chlorine atom attached to the nitrogen atom in the amide group. It also contains a 3,3-diphenylpropyl group attached to the carbon atom of the acetamide. 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE is of interest in the field of medicinal and synthetic chemistry due to its structural features and potential applications.

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  • Acetamide,2-chloro-N-(3,3-diphenylpropyl)-

    Cas No: 137075-21-9

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  • 137075-21-9 Structure
  • Basic information

    1. Product Name: 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE
    2. Synonyms: 2-Chloro-N-(3,3-diphenylpropyl)acetamide;2-chloro-N-(3,3-diphenylpropyl)acetamide;
    3. CAS NO:137075-21-9
    4. Molecular Formula: C17H18ClNO
    5. Molecular Weight: 287.7839
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 137075-21-9.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 479.1 °C at 760 mmHg
    3. Flash Point: 243.5 °C
    4. Appearance: /
    5. Density: 1.137 g/cm3
    6. Vapor Pressure: 2.44E-09mmHg at 25°C
    7. Refractive Index: 1.566
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE(137075-21-9)
    12. EPA Substance Registry System: 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE(137075-21-9)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 137075-21-9(Hazardous Substances Data)

137075-21-9 Usage

Uses

Used in Pharmaceutical Research:
2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE is used as a research compound for investigating its potential applications in drug development. Its unique structural features may contribute to the discovery of new therapeutic agents.
Used in Drug Development:
Due to its structural characteristics, 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE may have potential applications in the development of new drugs. Its properties could be harnessed to create medications that target specific biological pathways or diseases.
Used as a Building Block in Organic Synthesis:
2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE may also be used as a building block in organic synthesis. Its chemical structure can be further modified or used as a starting material to create more complex molecules with various applications in chemistry and medicine.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE may exhibit biological activity, making it a valuable compound for studying its interactions with biological targets and its potential therapeutic effects.
Overall, 2-CHLORO-N-(3,3-DIPHENYLPROPYL)ACETAMIDE is a versatile chemical compound with potential applications in various industries, particularly in pharmaceutical research and development, as well as in organic synthesis and medicinal chemistry.

Check Digit Verification of cas no

The CAS Registry Mumber 137075-21-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,3,7,0,7 and 5 respectively; the second part has 2 digits, 2 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 137075-21:
(8*1)+(7*3)+(6*7)+(5*0)+(4*7)+(3*5)+(2*2)+(1*1)=119
119 % 10 = 9
So 137075-21-9 is a valid CAS Registry Number.
InChI:InChI=1/C17H18ClNO/c18-13-17(20)19-12-11-16(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,19,20)

137075-21-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-Chloro-N-(3,3-diphenylpropyl)acetamide

1.2 Other means of identification

Product number -
Other names N-chloromethyl-3,3-diphenylpropionamide

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:137075-21-9 SDS

137075-21-9Relevant articles and documents

Thioimidazoline based compounds reverse glucocorticoid resistance in human acute lymphoblastic leukemia xenografts

Toscan, Cara E.,Rahimi, Marwa,Bhadbhade, Mohan,Pickford, Russell,McAlpine, Shelli R.,Lock, Richard B.

, p. 6299 - 6312 (2015/06/08)

Glucocorticoids form a critical component of chemotherapy regimens for pediatric acute lymphoblastic leukemia (ALL) and the initial response to glucocorticoid therapy is a major prognostic factor, where resistance is predictive of poor outcome. A high-throughput screen identified four thioimidazoline-containing compounds that reversed dexamethasone resistance in an ALL xenograft derived from a chemoresistant pediatric ALL. The lead compound (1) was synergistic when used in combination with the glucocorticoids, dexamethasone or prednisolone. Synergy was observed in a range of dexamethasone-resistant xenografts representative of B-cell precursor ALL (BCP-ALL) and T-cell ALL. We describe here the synthesis of twenty compounds and biological evaluation of thirty two molecules that explore the structure-activity relationships (SAR) of this novel class of glucocorticoid sensitizing compounds. SAR analysis has identified that the most effective dexamethasone sensitizers contain a thioimidazoline acetamide substructure with a large hydrophobic moiety on the acetamide. This journal is

DERIVATIVES OF UREA AND RELATED DIAMINES, METHODS FOR THEIR MANUFACTURE, AND USES THEREFOR

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Page/Page column 136-137, (2008/06/13)

Compounds of formula (I): Z is >CH-, >C=CH- or >N-, R1 and R2 are optionally substituted and are the same or different, and each represents an aryl group, a heteroaryl group, or Z, R1 and R2 form a fused ring structure of formula: in which A represents a single bond, or linking group, R3 represents hydrogen, a group selected from: -AIkCOOR, -AIkNR7R8, -AIkCONR7R8, -AIkCOR9, -AIkSO2NR10R10', -AIkOR10, and -AIkS(O)nR10, in which AIk is alkyl, R is hydrogen or alkyl, R7 and R8 each represents H, optionally substituted alkyl, alkylaminoalkyl or dialkylaminoalkyl, or CONR7R8 forms an optionally substituted heterocycle, and R10 and R10 are hydrogen atom, optionally substituted alkyl, an alkylaminoalkyl group, an optionally substituted cycle, optionally spaced by an AIk group as defined, Q represents >C=0 or >C=S, R5 is a hydrogen atom or an alkyl, alkoxy, hydroxyalkyl, alkylthio, or thioalkyl group, p is 1, 2 or 3, q is 0, 1 or 2, R6 represents an optionally substituted aryl or heteroaryl group, and salts and esters thereof, are useful as calcimimetics in therapy.

UREA DERIVATIVES USEFUL AS CALCIUM RECEPTOR MODULATORS

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Page/Page column 48; 155-156, (2008/06/13)

The present invention provides compounds of formula (I): in which Y is oxygen or sulphur; R1 and R”1 are optionally substituted aryl, heteroaryl or a fused ring structure, R2and R'2 are each H, or optionally substituted alkyl, alkylaminoalkyl or dialkylaminoalkyl, or R2 and R'2 and their N form a saturated or unsaturated optionally substituted heterocycle, R3 represents a group of formula -(CH2)P-Ar-Rn, wherein p is 0 or 1 and, when p is 1, is optionally substituted, Ar is aryl or heteroaryl, and each R is H, halogen; hydroxyl; trifiuoromethyl; linear and branched alkyl, alkenyl, alkynyl, and alkoxyl groups, all optionally further substituted by one or more of hydroxy groups, halogen atoms, alkoxy groups, amino groups, and alkylthio groups; linear and branched alkoxyl groups; linear and branched thioalkyl groups; aryl groups; aralkyl groups; aralkoxy groups; aryloxy groups; perfluoroalkyl; -CN; -NR4R5, -C(=X)NR4R5,-O-C(=X)NR4R5, -SO2NR4R5, - Alk-NR4R5, -NZC(=X)(NH)qR6, -Alk-NZC(=X)(NH)qR6, -C(=X)R6, -Alk-C(=X)(NH)qR6, -NHSO2R7, -SO2R7, -SOR7, -SR7, or is a saturated or unsaturated heterocyclyl group, and salts and esters thereof, are useful in the treatment of conditions susceptible to modulating ion channels, to a process for their preparation, their application by way of medicaments, and to pharmaceutical compositions containing them.

AZACYCLIC COMPOUNDS AS INHIBITORS OF SENSORY NEURONE SPECIFIC CHANNELS

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Page 50, (2010/02/10)

Compounds of the formula (I), and pharmaceutically acceptable salts thereof, are found to be antagonists of SNS sodium channels. They are therefore useful as analgesic and neuroprotective agents wherein: X is -N- or -CH-; n is from 0 to 3.

(Pyridylcyanomethyl)piperazines as orally active PAF antagonists

Carceller,Almansa,Merlos,Giral,Bartroli,Garcia-Rafanell,Forn

, p. 4118 - 4134 (2007/10/02)

A series of (pyridylcyanomethyl)piperazines was prepared and evaluated for PAF-antagonist activity. Compounds were tested in vitro in a PAF-induced platelet aggregation assay and in vivo in a PAF-induced hypotension test in normotensive rats. Oral activity was ascertained through a PAF-induced mortality test in mice. The main structure-activity trends of the series were established. Activity was mainly found in four skeletons: 1-acyl-4-(3- pyridylcyanomethyl)-piperazine, 1-acyl-4-(4-pyridylcyanomethyl)piperazine, 1- acyl-4-(3-pyridylcyanomethyl)piperidine, and 1-acyl-4-cyano-4-(3- pyridylamino)piperidine. The acyl substituents, diphenylacetyl and 3,3- diphenylpropionyl, provided the most active compounds, and the introduction of an amine or hydroxy group in the 3,3-diphenylpropionyl substituent led to further improvement in oral activity. As a result, three of the most active compounds (100, 114, and 115) have been selected for further pharmacological development.

(cyanomethyl)pyridines useful as PAF antagonists

-

, (2008/06/13)

57 The present invention relates to new (cyanomethyl)pyridines of general formula I: wherein Ais nitrogen and Bis -CH-, or Bis nitrogen and Ais -CH-; the group Y-W-represents a group of formula N-CR1(CN)-, N-CH2-CH(CN)-, CH-CH(CN)- or C=C(CN)- wherein R1 is hydrogen or a C1-C6 alkyl group; Rrepresents a group of formula R2CO-,R3R4N-(CH2)nCO- or R5-(CH2)m- wherein R2 represents C1-C15 alkyl, aryl, aryl-(C1-C6)-alkyl, aryl-(C1-C6)-alkenyl, diaryl-(C1-C6)-alkyl, diaryl-(C1-C6)-alkenyl, arylhydroxy-(C1-C6)-alkyl, diarylhydroxy-(C1-C6)-alkyl, aryl-(C1-C6)-alkoxy, diaryl-(C1-C6)-alkoxy, or heteroaryl-(C1-C6)-alkyl group; n is 0, 1, 2 or 3; R3 is hydrogen, C1-C6 alkyl, aryl or aryl-(C1-C6)-alkyl group; R4 is C3-C6 cycloalkyl, aryl, aryl-(C1-C6)-alkyl, diaryl-(C1-C6)-alkyl, aryl-(C1-C6)-alkylcarbonyl or diaryl-(C1-C6)-alkylcarbonyl group; m is 0, 1 or 2; and R5 is aryl-(C1-C6)-alkyl, diaryl-(C1-C6)-alkyl, diaryl-(C1-C6)-alkylcarbonylamino or diaryl-(C1-C6)-alkylaminocarbonyl group. These compounds are potent, orally active PAF antagonists and consequently, useful in the treatment of the diseases in which this substance is involved.

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