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(R)-1-ethyl-3-(6-fluoro-5-(2-(2-hydroxypropan-2-yl)pyrimidin-5-yl)-7-(tetrahydrofuran-2-yl)-1H-benzo[d]imidazol-2-yl)urea is a complex urea derivative characterized by a rich molecular structure that includes a urea functional group, an ethyl group, a fluoro group, a pyrimidine ring, a tetrahydrofuran group, and a benzoimidazole ring. Its intricate design suggests potential for interaction with biological systems, making it a candidate of interest for the pharmaceutical industry.

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  • 3-ethyl-1-{5-fluoro-6-[2-(2-hydroxypropan-2-yl)pyrimidin-5-yl]-4-[(2R)-oxolan-2-yl]-1H-1,3-benzodiazol-2-yl}urea

    Cas No: 1384984-18-2

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  • 1384984-18-2 Structure
  • Basic information

    1. Product Name: (R)-1-ethyl-3-(6-fluoro-5-(2-(2-hydroxypropan-2-yl)pyrimidin-5-yl)-7-(tetrahydrofuran-2-yl)-1H-benzo[d]imidazol-2-yl)urea
    2. Synonyms: (R)-1-ethyl-3-(6-fluoro-5-(2-(2-hydroxypropan-2-yl)pyrimidin-5-yl)-7-(tetrahydrofuran-2-yl)-1H-benzo[d]imidazol-2-yl)urea;VXC-486;EOS-60709;1-ethyl-3-[5-fluoro-6-[2-(2-hydroxypropan-2-yl)pyrimidin-5-yl]-4-[(2R)-oxolan-2-yl]-1H-benzimidazol-2-yl]urea
    3. CAS NO:1384984-18-2
    4. Molecular Formula: C21H25FN6O3
    5. Molecular Weight: 428.4600032
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 1384984-18-2.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.374±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: 8.31±0.30(Predicted)
    10. CAS DataBase Reference: (R)-1-ethyl-3-(6-fluoro-5-(2-(2-hydroxypropan-2-yl)pyrimidin-5-yl)-7-(tetrahydrofuran-2-yl)-1H-benzo[d]imidazol-2-yl)urea(CAS DataBase Reference)
    11. NIST Chemistry Reference: (R)-1-ethyl-3-(6-fluoro-5-(2-(2-hydroxypropan-2-yl)pyrimidin-5-yl)-7-(tetrahydrofuran-2-yl)-1H-benzo[d]imidazol-2-yl)urea(1384984-18-2)
    12. EPA Substance Registry System: (R)-1-ethyl-3-(6-fluoro-5-(2-(2-hydroxypropan-2-yl)pyrimidin-5-yl)-7-(tetrahydrofuran-2-yl)-1H-benzo[d]imidazol-2-yl)urea(1384984-18-2)
  • 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: 1384984-18-2(Hazardous Substances Data)

1384984-18-2 Usage

Uses

Used in Pharmaceutical Industry:
(R)-1-ethyl-3-(6-fluoro-5-(2-(2-hydroxypropan-2-yl)pyrimidin-5-yl)-7-(tetrahydrofuran-2-yl)-1H-benzo[d]imidazol-2-yl)urea is used as a potential pharmaceutical agent for its diverse structure that may allow for targeted interactions with biological systems. The specific application reason would depend on the results of further research and testing to understand its properties and potential therapeutic effects.
Given the complexity of the compound and the lack of specific application details in the provided materials, the exact uses within the pharmaceutical industry are not specified. However, the compound's structural features suggest it could be developed for various therapeutic applications, such as targeting specific receptors or enzymes in the treatment of diseases. Further research would be necessary to explore these possibilities and to determine the safety and efficacy of the compound in medical applications.

Check Digit Verification of cas no

The CAS Registry Mumber 1384984-18-2 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,3,8,4,9,8 and 4 respectively; the second part has 2 digits, 1 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 1384984-18:
(9*1)+(8*3)+(7*8)+(6*4)+(5*9)+(4*8)+(3*4)+(2*1)+(1*8)=212
212 % 10 = 2
So 1384984-18-2 is a valid CAS Registry Number.

1384984-18-2Relevant articles and documents

Second-generation antibacterial benzimidazole ureas: Discovery of a preclinical candidate with reduced metabolic liability

Grillot, Anne-Laure,Tiran, Arnaud Le,Shannon, Dean,Krueger, Elaine,Liao, Yusheng,Odowd, Hardwin,Tang, Qing,Ronkin, Steve,Wang, Tiansheng,Waal, Nathan,Li, Pan,Lauffer, David,Sizensky, Emmanuelle,Tanoury, Jerry,Perola, Emanuele,Grossman, Trudy H.,Doyle, Tim,Hanzelka, Brian,Jones, Steven,Dixit, Vaishali,Ewing, Nigel,Liao, Shengkai,Boucher, Brian,Jacobs, Marc,Bennani, Youssef,Charifson, Paul S.

, p. 8792 - 8816 (2015/03/14)

Compound 3 is a potent aminobenzimidazole urea with broad-spectrum Gram-positive antibacterial activity resulting from dual inhibition of bacterial gyrase (GyrB) and topoisomerase IV (ParE), and it demonstrates efficacy in rodent models of bacterial infec

COMBINATION THERAPY COMPRISING|1 -ETHYL-3-[5-[2-{1 -HYDROXY-1 -METHYL-ETHYL}PYRIMIDIN-5-YL]-7-(TETRA HYDROFURAN-2-|YL}-1 H-BENZIMIDAZOL-2-YL]UREA AND DERIVATIVES THEREOF TO TREAT MYCOBACTERIUM|DISEASES

-

, (2014/02/15)

The present invention relates to combination therapies comprising a compound of formula (I) or a pharmaceutically acceptable salt thereof wherein X and R are as defined herein. The compounds of formula (I) are useful as gyrase and/or topoisomerase IV inhi

SOLID FORMS OF (R)-2-(5-(2-(3-ETHYLUREIDO)-6-FLUORO-7-(TETRAHYDROFURAN-2-YL)-1H-BENZO[D]IMIDAZOL-5-YL)PYRIMIDIN-2-YL)PROPAN-2-YL DIHYDROGEN PHOSPHATE AND SALTS THEREOF

-

, (2014/02/15)

The invention relates to solid forms of the Formula (I) wherein X is -PO(OH)2, -PO(OH)O-M+, or -PO(O-)2?2M+,wherein M is a monovalent cation such as Na+, K+, Li+, or NH4+. The invention also provides pharmaceutically acceptable compositions comprising the solid form of he compound and method of using the compositions in the treatment of various disorders.

GYRASE AND TOPOISOMERASE IV INHIBITORS

-

, (2012/07/28)

The present invention relates to a compound of formula (I) or a pharmaceutically acceptable salt thereof wherein X and R are as defined herein. The compounds of formula (I) are useful as gyrase and/or topoisomerase IV inhibitors for treating bacterial infections. The compounds of formula (I) either possess a broad range of anti-bacterial activity and advantageous toxicological properties or are prodrugs of compounds having said activity.

PROCESS OF MAKING GYRASE AND TOPOISOMERASE IV INHIBITORS

-

, (2012/07/28)

The present application is directed to compounds, intermediates and methods for preparing compounds of formula (I) or a pharmaceutically acceptable salts thereof, wherein R is H or F, and each of R3, R4, and R5 are as defined herein. The compounds of formula (I) and pharmaceutical compositions comprising said compounds and salts inhibit bacterial gyrase and/or Topo IV and are useful in treating bacterial infections.

SOLID FORMS OF GYRASE INHIBITOR (R)-1-ETHYL-3-[6-FLUORO-5-[2-(1-HYDROXY-1-METHYL-ETHYL)PYRIMIDIN-5-YL]-7-(TETRAHYDROFURAN-2-YL)-1H-BENZIMIDAZOL-2-YL]UREA

-

, (2012/07/28)

The present application is directed to solid forms of compounds of formula I: and pharmaceutically acceptable salts thereof, that inhibit bacterial gyrase and/or Topo IV and pharmaceutical compositions comprising said compounds and salts. These compounds and salts are useful in treating bacterial infections.

PHOSPHATE ESTERS OF GYRASE AND TOPOISOMERASE INHIBITORS

-

, (2013/02/28)

The present invention relates to phosphate esters of compounds that inhibit bacterial gyrase and/or Topoisomerase IV and pharmaceutical compositions thereof. These phosphate esters are useful for treating bacterial infections.

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