F0475-0067
TL;DR: F0475-0067 (CAS 391886-54-7) is a chemical compound with molecular formula C16H12FN5O3S and molecular weight 373.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-nitrobenzamide
Also Known As: F0475-0067, N-{[4-(4-fluorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-4-nitrobenzamide, N-((4-(4-fluorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-4-nitrobenzamide, N-[[4-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-nitrobenzamide, N-{[4-(p-fluorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}p-nitrobenzamide
| Molecular Formula | C16H12FN5O3S |
|---|---|
| Molecular Weight | 373.06 g/mol |
| LogP | 2.90719 |
| Topological Polar Surface Area | 105.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.06448 |
| Heavy Atoms | 26 |
| Complexity | 1011.6145 |
Chemical Identifiers
| CAS Number | 391886-54-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NCC2=NNC(=S)N2C3=CC=C(C=C3)F)[N+](=O)[O-] |
Product Overview
F0475-0067 (CAS 391886-54-7), with molecular formula C16H12FN5O3S and molecular weight 373.06 g/mol. IUPAC: N-[[4-(4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-nitrobenzamide.
Chemical Property Profile of F0475-0067
Property Insights of F0475-0067
The XLogP value of 2.90719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0475-0067. The TPSA of 105.85 Ų falls within the moderate polarity range, balancing permeability and solubility for F0475-0067. Following Lipinski's Rule of Five, F0475-0067 has 2 hydrogen bond donor(s) and 5 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 F0475-0067?
The CAS number of F0475-0067 is 391886-54-7.
What is the molecular formula of F0475-0067?
The molecular formula of F0475-0067 is C16H12FN5O3S.
What is the molecular weight of F0475-0067?
The molecular weight of F0475-0067 is 373.06 g/mol.
Where can I buy F0475-0067?
You can request a quote for F0475-0067 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0475-0067?
Yes, KEHONG BIO provides custom synthesis services for F0475-0067 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.