1H-358S
TL;DR: 1H-358S (CAS 321431-58-7) is a chemical compound with molecular formula C16H11F3N4O and molecular weight 332.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-difluorophenyl)-N-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide
Also Known As: 1H-358S, 1-(2,4-difluorophenyl)-N-(4-fluorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxamide, 1-(2,4-difluorophenyl)-N-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide, 1H-1,2,4-Triazole-3-carboxamide, 1-(2,4-difluorophenyl)-N-(4-fluorophenyl)-5-methyl-
| Molecular Formula | C16H11F3N4O |
|---|---|
| Molecular Weight | 332.09 g/mol |
| LogP | 3.24532 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.0885 |
| Heavy Atoms | 24 |
| Complexity | 906.18604 |
Chemical Identifiers
| CAS Number | 321431-58-7 |
|---|---|
| SMILES | CC1=NC(=NN1C2=C(C=C(C=C2)F)F)C(=O)NC3=CC=C(C=C3)F |
Product Overview
1H-358S (CAS 321431-58-7), with molecular formula C16H11F3N4O and molecular weight 332.09 g/mol. IUPAC: 1-(2,4-difluorophenyl)-N-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide.
Chemical Property Profile of 1H-358S
Property Insights of 1H-358S
The XLogP value of 3.24532 indicates that 1H-358S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, 1H-358S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-358S 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 1H-358S?
The CAS number of 1H-358S is 321431-58-7.
What is the molecular formula of 1H-358S?
The molecular formula of 1H-358S is C16H11F3N4O.
What is the molecular weight of 1H-358S?
The molecular weight of 1H-358S is 332.09 g/mol.
Where can I buy 1H-358S?
You can request a quote for 1H-358S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-358S?
Yes, KEHONG BIO provides custom synthesis services for 1H-358S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.