Voriconazole
TL;DR: Voriconazole (CAS 137234-71-0) is a chemical compound with molecular formula C16H14F3N5O and molecular weight 349.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol
Also Known As: Voriconazole, ent-Voriconazole, Voriconazole-d3, Copper sulfocyanide, 2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
| Molecular Formula | C16H14F3N5O |
|---|---|
| Molecular Weight | 349.12 g/mol |
| LogP | 2.1769 |
| Topological Polar Surface Area | 76.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.11505 |
| Heavy Atoms | 25 |
| Complexity | 873.96655 |
Chemical Identifiers
| CAS Number | 137234-71-0 |
|---|---|
| SMILES | CC(C1=NC=NC=C1F)C(CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O |
Product Overview
Voriconazole (CAS 137234-71-0), with molecular formula C16H14F3N5O and molecular weight 349.12 g/mol. IUPAC: 2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol.
Chemical Property Profile of Voriconazole
Property Insights of Voriconazole
The XLogP value of 2.1769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Voriconazole. The TPSA of 76.72 Ų falls within the moderate polarity range, balancing permeability and solubility for Voriconazole. Following Lipinski's Rule of Five, Voriconazole has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Voriconazole?
The CAS number of Voriconazole is 137234-71-0.
What is the molecular formula of Voriconazole?
The molecular formula of Voriconazole is C16H14F3N5O.
What is the molecular weight of Voriconazole?
The molecular weight of Voriconazole is 349.12 g/mol.
Where can I buy Voriconazole?
You can request a quote for Voriconazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Voriconazole?
Yes, KEHONG BIO provides custom synthesis services for Voriconazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.