F0475-0097
TL;DR: F0475-0097 (CAS 391886-70-7) is a chemical compound with molecular formula C20H21FN4OS and molecular weight 384.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[[4-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0475-0097, 4-tert-butyl-N-{[4-(4-fluorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}benzamide, 4-tert-butyl-N-[[4-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide, 4-(tert-butyl)-N-((4-(4-fluorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)benzamide
| Molecular Formula | C20H21FN4OS |
|---|---|
| Molecular Weight | 384.14 g/mol |
| LogP | 4.29649 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.142 |
| Heavy Atoms | 27 |
| Complexity | 998.20123 |
Chemical Identifiers
| CAS Number | 391886-70-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NCC2=NNC(=S)N2C3=CC=C(C=C3)F |
Product Overview
F0475-0097 (CAS 391886-70-7), with molecular formula C20H21FN4OS and molecular weight 384.14 g/mol. IUPAC: 4-tert-butyl-N-[[4-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0475-0097
Property Insights of F0475-0097
The XLogP value of 4.29649 indicates that F0475-0097 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 F0475-0097. Following Lipinski's Rule of Five, F0475-0097 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 F0475-0097?
The CAS number of F0475-0097 is 391886-70-7.
What is the molecular formula of F0475-0097?
The molecular formula of F0475-0097 is C20H21FN4OS.
What is the molecular weight of F0475-0097?
The molecular weight of F0475-0097 is 384.14 g/mol.
Where can I buy F0475-0097?
You can request a quote for F0475-0097 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0475-0097?
Yes, KEHONG BIO provides custom synthesis services for F0475-0097 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.