Bionet1_000991
TL;DR: Bionet1_000991 (CAS 321431-50-9) is a chemical compound with molecular formula C17H11F5N4O and molecular weight 382.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide
Also Known As: Bionet1_000991, 1H-350S, N-(3,4-difluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-3-carboxamide, N-(3,4-difluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide
| Molecular Formula | C17H11F5N4O |
|---|---|
| Molecular Weight | 382.09 g/mol |
| LogP | 4.12502 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.0853 |
| Heavy Atoms | 27 |
| Complexity | 1012.79865 |
Chemical Identifiers
| CAS Number | 321431-50-9 |
|---|---|
| SMILES | CC1=NC(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)F)F |
Product Overview
Bionet1_000991 (CAS 321431-50-9), with molecular formula C17H11F5N4O and molecular weight 382.09 g/mol. IUPAC: N-(3,4-difluorophenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide.
Chemical Property Profile of Bionet1_000991
Property Insights of Bionet1_000991
The XLogP value of 4.12502 indicates that Bionet1_000991 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, Bionet1_000991 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_000991 has 1 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 Bionet1_000991?
The CAS number of Bionet1_000991 is 321431-50-9.
What is the molecular formula of Bionet1_000991?
The molecular formula of Bionet1_000991 is C17H11F5N4O.
What is the molecular weight of Bionet1_000991?
The molecular weight of Bionet1_000991 is 382.09 g/mol.
Where can I buy Bionet1_000991?
You can request a quote for Bionet1_000991 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000991?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000991 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.