F0475-0042
TL;DR: F0475-0042 (CAS 391886-41-2) is a chemical compound with molecular formula C16H12ClFN4OS and molecular weight 362.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-3-fluorobenzamide
Also Known As: F0475-0042, N-{[4-(3-chlorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-3-fluorobenzamide, N-((4-(3-chlorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-3-fluorobenzamide, N-[[4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-3-fluorobenzamide, N-[[4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-3-fluoro-benzamide
| Molecular Formula | C16H12ClFN4OS |
|---|---|
| Molecular Weight | 362.04 g/mol |
| LogP | 3.65239 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.04044 |
| Heavy Atoms | 24 |
| Complexity | 953.0005 |
Chemical Identifiers
| CAS Number | 391886-41-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)C(=O)NCC2=NNC(=S)N2C3=CC(=CC=C3)Cl |
Product Overview
F0475-0042 (CAS 391886-41-2), with molecular formula C16H12ClFN4OS and molecular weight 362.04 g/mol. IUPAC: N-[[4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-3-fluorobenzamide.
Chemical Property Profile of F0475-0042
Property Insights of F0475-0042
The XLogP value of 3.65239 indicates that F0475-0042 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 F0475-0042. Following Lipinski's Rule of Five, F0475-0042 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 F0475-0042?
The CAS number of F0475-0042 is 391886-41-2.
What is the molecular formula of F0475-0042?
The molecular formula of F0475-0042 is C16H12ClFN4OS.
What is the molecular weight of F0475-0042?
The molecular weight of F0475-0042 is 362.04 g/mol.
Where can I buy F0475-0042?
You can request a quote for F0475-0042 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0475-0042?
Yes, KEHONG BIO provides custom synthesis services for F0475-0042 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.