N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide
TL;DR: N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide (CAS 712286-63-0) is a chemical compound with molecular formula C10H7F3N4O and molecular weight 256.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide
Also Known As: N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide, Benzamide,N-1H-1,2,4-triazol-5-yl-3-(trifluoromethyl)-, N-(2H-1,2,4-triazol-3-yl)-3-(trifluoromethyl)benzamide, Benzamide, N-1H-1,2,4-triazol-3-yl-3-(trifluoromethyl)- (9CI), N-(1H-1,2,4-triazol-3-yl)[3-(trifluoromethyl)phenyl]carboxamide
| Molecular Formula | C10H7F3N4O |
|---|---|
| Molecular Weight | 256.06 g/mol |
| LogP | 2.0758 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.0572 |
| Heavy Atoms | 18 |
| Complexity | 550.5005 |
Chemical Identifiers
| CAS Number | 712286-63-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)NC2=NC=NN2 |
Product Overview
N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide (CAS 712286-63-0), with molecular formula C10H7F3N4O and molecular weight 256.06 g/mol. IUPAC: N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide.
Chemical Property Profile of N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide
Property Insights of N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide
The XLogP value of 2.0758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide. Following Lipinski's Rule of Five, N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide has 2 hydrogen bond donor(s) and 3 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 N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide?
The CAS number of N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide is 712286-63-0.
What is the molecular formula of N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide?
The molecular formula of N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide is C10H7F3N4O.
What is the molecular weight of N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide?
The molecular weight of N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide is 256.06 g/mol.
Where can I buy N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide?
You can request a quote for N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-1,2,4-triazol-5-yl)-3-(trifluoromethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.