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259809-47-7

6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE is a chemical compound that belongs to the class of naphthyridine carboxylates. It is a derivative of 1,6-naphthyridine and contains a tert-butyl group and a methyl group. Its unique chemical structure makes it valuable for drug discovery and development.
Used in Pharmaceutical Industry:
6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE is used as a building block for the synthesis of potential drug candidates due to its unique chemical structure and potential therapeutic applications.
Used in Medicinal Research:
6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE is used as a research compound for the development of new drugs to treat various diseases and conditions. Its properties are being further explored for potential therapeutic applications.

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  • 6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE

    Cas No: 259809-47-7

  • USD $ 1.9-2.9 / Gram

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  • 259809-47-7 Structure

  • Basic information

    1. Product Name: 6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE
    2. Synonyms: 6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE;7,8-Dihydro-5H-[1,6]naphthyridine-2,6-dicarboxylic acid 6-tert-butyl ester 2-methyl ester;6-tert-Butyl 2-methyl 7,8-dihydro-1,6-naphthyridine-2,6(5H);6-Tert-Butyl 2-Methyl 7,8-Dihydro-1,6-Naphthyridine-2,6(5H)-Dicarboxylate(WX142002)
    3. CAS NO:259809-47-7
    4. Molecular Formula: C15H20N2O4
    5. Molecular Weight: 292.3303
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 259809-47-7.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 432.899°C at 760 mmHg
    3. Flash Point: 215.61°C
    4. Appearance: /
    5. Density: 1.19g/cm3
    6. Vapor Pressure: 0mmHg at 25°C
    7. Refractive Index: 1.537
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 1.52±0.20(Predicted)
    11. CAS DataBase Reference: 6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE(CAS DataBase Reference)
    12. NIST Chemistry Reference: 6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE(259809-47-7)
    13. EPA Substance Registry System: 6-TERT-BUTYL 2-METHYL 7,8-DIHYDRO-1,6-NAPHTHYRIDINE-2,6(5H)-DICARBOXYLATE(259809-47-7)

  • 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: 259809-47-7(Hazardous Substances Data)

259809-47-7 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 259809-47-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,5,9,8,0 and 9 respectively; the second part has 2 digits, 4 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 259809-47:
(8*2)+(7*5)+(6*9)+(5*8)+(4*0)+(3*9)+(2*4)+(1*7)=187
187 % 10 = 7
So 259809-47-7 is a valid CAS Registry Number.
InChI:InChI=1/C15H20N2O4/c1-15(2,3)21-14(19)17-8-7-11-10(9-17)5-6-12(16-11)13(18)20-4/h5-6H,7-9H2,1-4H3

259809-47-7SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name 6-O-tert-butyl 2-O-methyl 7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxylate

1.2 Other means of identification

Product number -
Other names -

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:259809-47-7 SDS

259809-47-7Relevant articles and documents

PIPERIDINYL AMINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE

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Page/Page column 56-57, (2021/04/03)

The present invention relates to compounds of formula (I), wherein R1, R2, R3, R4 and R5 are as described herein, and their pharmaceutically acceptable salt, enantiomer or diastereomer thereof, and co

SUBSTITUTE 1, 6-NAPHTHYRIDINES FOR USE AS SCD INHIBITORS

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Page/Page column 42, (2009/06/27)

The present invention relates to substituted tetrahydronaphthyridine (THN) compounds of the formula (I) and salts thereof, to pharmaceutical compositions containing them and their use in medicine. In particular, the invention relates to compounds for inhibiting SCD activity.

Synthesis and conformational analysis of a non-amidine factor Xa inhibitor that incorporates 5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine as S4 binding element

Haginoya, Noriyasu,Kobayashi, Syozo,Komoriya, Satoshi,Yoshino, Toshiharu,Suzuki, Makoto,Shimada, Takashi,Watanabe, Kengo,Hirokawa, Yumiko,Furugori, Taketoshi,Nagahara, Takayasu

, p. 5167 - 5182 (2007/10/03)

Our exploratory study was based on the concept that a non-amidine factor Xa (fXa) inhibitor is suitable for an orally available anticoagulant. We synthesized and evaluated a series of N-(6-chloronaphthalen-2-yl) sulfonylpiperazine derivatives incorporating various fused-bicyclic rings containing an aliphatic amine expected to be S4 binding element. Among this series, 5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine type 61 displayed orally potent anti-fXa activity and evident prolongation of prothrombin time (PT) with the moderate bioavailability in rats. The X-ray crystal analysis afforded an obvious binding mode that 5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c] pyridine and 6-chloronaphthalene respectively bound to S4 and S1 subsites. In this X-ray study, we discovered a novel intramolecular S-O close contact. Ab initio energy calculations of model compounds deduced that conformers with the most close S-O proximity were most stable. The Mulliken population analysis proposed that this energy profile was caused by both of electrostatic S-O affinity and N-O repulsion. The results of these calculations and X-ray analysis suggested a possibility that the restricted conformation effected the affinity to S4 subsite of fXa.

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