Telangana Pharmatech

CAS 188416-35-5

Chemistry, 3 End Use API, 16 Related Intermediates

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Also known as: 1184919-11-6, 3-(6-chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)butan-2-ol;hydrochloride, (2r,3s/2s,3r)-3-(4-chloro-5-fluoro-6-pyrimidinyl)-2-(2,4-difluorophenyl)butan-2-ol hydrochloride, Dtxsid40657714, Akos015998846, Am84649

Molecular Formula

C₁₄H₁₃Cl₂F₃N₂O

Molecular Weight

353.2 g/mol

InChI Key

KNFRQNVARBDXRG-UHFFFAOYSA-N

1 2D Structure

CAS 188416-35-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-(6-chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)butan-2-ol;hydrochloride

2.1.2 InChI

InChI=1S/C14H12ClF3N2O.ClH/c1-7(12-11(18)13(15)20-6-19-12)14(2,21)9-4-3-8(16)5-10(9)17;/h3-7,21H,1-2H3;1H

2.1.3 InChI Key

KNFRQNVARBDXRG-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC(C1=C(C(=NC=N1)Cl)F)C(C)(C2=C(C=C(C=C2)F)F)O.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1184919-11-6

2. 3-(6-chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)butan-2-ol;hydrochloride

3. (2r,3s/2s,3r)-3-(4-chloro-5-fluoro-6-pyrimidinyl)-2-(2,4-difluorophenyl)butan-2-ol Hydrochloride

4. Dtxsid40657714

5. Akos015998846

6. Am84649

7. Sb58235

8. A24986

9. 3-(6-chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)butan-2-olhydrochloride

10. 3-(6-chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)butan-2-ol--hydrogen Chloride (1/1)

2.3 Create Date

2009-09-01

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₁₃Cl₂F₃N₂O
Molecular Weight	353.2 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	352.0357029 g/mol
Monoisotopic Mass	352.0357029 g/mol
Topological Polar Surface Area	46 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	365
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

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2,4-Dichloro-5-fluoropyrimidine

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CAS Number

2927-71-1

End Use API

Voriconazole

About the Company

Telangana Pharmatech is a specialty pharmaceutical company engaged in the drug development, manufacture a...

Telangana Pharmatech is a specialty pharmaceutical company engaged in the drug development, manufacture and commercialization of pharmaceutical products. The company is floated by eminent professionals with vast experience in production, Research and Development, quality Assurance and marketing of API's and formulated medicines in India and abroad. Telangana Pharmatech Focuses On Development Of Novel Scaffolds And Design Of New Synthetic Routes For NCEs, Optimize Existing Route To Scale Up By Reducing Steps, Time And Cost. FTE Based Synthesis With Multiple-Chemist Multistage Synthesis.

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