DRL offers a portfolio of products & services, including APIs, CMO services, generics, biosimilars & differentiated formulations.

Contact Supplier

Valsynthese, part of the SSE Group, is a CDMO focused on highly energetic and highly hazardous chemistry.

ACCESS ALL DATA
Browse all information
CHEMISTRY
Discover Molecule Insights

ACTIVE PHARMA INGREDIENTS

1 API Suppliers, 1 USDMF

1 API Suppliers
1 USDMF

Synopsis

ACTIVE PHARMA INGREDIENTS

API Suppliers

USDMF

CEP/COS

JDMF

EU WC

KDMF

NDC API

VMF

Listed Suppliers

API REF. PRICE (USD/KG)

$ 0

MARKET PLACE

API

FDF

0INTERMEDIATES

FINISHED DOSAGE FORMULATIONS

FDF Dossiers

FDA Orange Book

Europe

Canada

Australia

South Africa

Listed Dossiers

0 DRUGS IN DEVELOPMENT

DRUG PRODUCT COMPOSITIONS

REF. STANDARDS OR IMPURITIES

EDQM

USP

Others

PATENTS & EXCLUSIVITIES

US Patents

US Exclusivities

Health Canada Patents

DIGITAL CONTENT

Data Compilation #PharmaFlow

Stock Recap #PipelineProspector

Weekly News Recap #Phispers

News #PharmaBuzz

GLOBAL SALES INFORMATION

US Medicaid (USD)

Annual Reports (USD Million)

Finished Drug Prices

0RELATED EXCIPIENT COMPANIES

0EXCIPIENTS BY APPLICATIONS

Chemistry

Click the arrow to open the dropdown

Click the button for full data set

Also known as: 2-(2,4-difluorophenyl)-3-methylsulfonyl-1-(1,2,4-triazol-1-ylbutan-2-ol, Threo-2-(2,4-difluorophenyl)-3-methylsulfonyl-1-(1h-1,2,4-triazol-1-yl)butan-2-ol, Chembl175050, Schembl1455652, Dtxsid90923916, Rac-(2r*,3r*)-2-(2,4-difluorophenyl)-3-(methylsulfonyl)-1-(1,2,4-triazol-1-yl)-2-butanol

Molecular Formula

C₁₃H₁₅F₂N₃O₃S

Molecular Weight

331.34 g/mol

InChI Key

HFGZFHCWKKQGIS-UHFFFAOYSA-N

1 2D Structure

Genaconazole

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(2,4-difluorophenyl)-3-methylsulfonyl-1-(1,2,4-triazol-1-yl)butan-2-ol

2.1.2 InChI

InChI=1S/C13H15F2N3O3S/c1-9(22(2,20)21)13(19,6-18-8-16-7-17-18)11-4-3-10(14)5-12(11)15/h3-5,7-9,19H,6H2,1-2H3

2.1.3 InChI Key

HFGZFHCWKKQGIS-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)S(=O)(=O)C

2.2 Synonyms

2.2.1 MeSH Synonyms

1. Genaconazole

2. Sch 39304

3. Sch 42426

4. Sch 42427

5. Sch-39304

6. Sch-42426

7. Sch-42427

8. Sm 8668

9. Sm-8668

10. Threo-2-(2,4-difluorophenyl)-3-methylsulfonyl-1-(1h-1,2,4-triazol-1-yl)butan-2-ol

2.2.2 Depositor-Supplied Synonyms

1. 2-(2,4-difluorophenyl)-3-methylsulfonyl-1-(1,2,4-triazol-1-ylbutan-2-ol

2. Threo-2-(2,4-difluorophenyl)-3-methylsulfonyl-1-(1h-1,2,4-triazol-1-yl)butan-2-ol

3. Chembl175050

4. Schembl1455652

5. Dtxsid90923916

6. Rac-(2r*,3r*)-2-(2,4-difluorophenyl)-3-(methylsulfonyl)-1-(1,2,4-triazol-1-yl)-2-butanol

7. 2-(2,4-difluorophenyl)-3-(methanesulfonyl)-1-(1h-1,2,4-triazol-1-yl)butan-2-ol

2.3 Create Date

2005-08-01

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₁₅F₂N₃O₃S
Molecular Weight	331.34 g/mol
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	331.08021885 g/mol
Monoisotopic Mass	331.08021885 g/mol
Topological Polar Surface Area	93.5 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	487
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	1

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

Antifungal Agents

Substances that destroy fungi by suppressing their ability to grow or reproduce. They differ from FUNGICIDES, INDUSTRIAL because they defend against fungi present in human or animal tissues. (See all compounds classified as Antifungal Agents.)

API SUPPLIERS