F0475-0171
TL;DR: F0475-0171 (CAS 391887-13-1) is a chemical compound with molecular formula C17H13F3N4OS and molecular weight 378.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2-(trifluoromethyl)benzamide
Also Known As: F0475-0171, N-((4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-2-(trifluoromethyl)benzamide, N-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2-(trifluoromethyl)benzamide, N-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]-2-(trifluoromethyl)benzamide, N-[(4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]o-(trifluoromethyl)benzamide
| Molecular Formula | C17H13F3N4OS |
|---|---|
| Molecular Weight | 378.08 g/mol |
| LogP | 3.87869 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.0762 |
| Heavy Atoms | 26 |
| Complexity | 979.4182 |
Chemical Identifiers
| CAS Number | 391887-13-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NNC2=S)CNC(=O)C3=CC=CC=C3C(F)(F)F |
Product Overview
F0475-0171 (CAS 391887-13-1), with molecular formula C17H13F3N4OS and molecular weight 378.08 g/mol. IUPAC: N-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2-(trifluoromethyl)benzamide.
Chemical Property Profile of F0475-0171
Property Insights of F0475-0171
The XLogP value of 3.87869 indicates that F0475-0171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.71 Ų falls within the moderate polarity range, balancing permeability and solubility for F0475-0171. Following Lipinski's Rule of Five, F0475-0171 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 F0475-0171?
The CAS number of F0475-0171 is 391887-13-1.
What is the molecular formula of F0475-0171?
The molecular formula of F0475-0171 is C17H13F3N4OS.
What is the molecular weight of F0475-0171?
The molecular weight of F0475-0171 is 378.08 g/mol.
Where can I buy F0475-0171?
You can request a quote for F0475-0171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0475-0171?
Yes, KEHONG BIO provides custom synthesis services for F0475-0171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.