F0475-0068
TL;DR: F0475-0068 (CAS 391886-55-8) is a chemical compound with molecular formula C17H15N5O3S and molecular weight 369.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-nitrobenzamide
Also Known As: F0475-0068, N-{[4-(3-methylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-4-nitrobenzamide, 4-nitro-N-((5-thioxo-4-(m-tolyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)benzamide, N-[[4-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-nitrobenzamide
| Molecular Formula | C17H15N5O3S |
|---|---|
| Molecular Weight | 369.09 g/mol |
| LogP | 3.07651 |
| Topological Polar Surface Area | 105.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.08957 |
| Heavy Atoms | 26 |
| Complexity | 1023.3777 |
Chemical Identifiers
| CAS Number | 391886-55-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=NNC2=S)CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
F0475-0068 (CAS 391886-55-8), with molecular formula C17H15N5O3S and molecular weight 369.09 g/mol. IUPAC: N-[[4-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-nitrobenzamide.
Chemical Property Profile of F0475-0068
Property Insights of F0475-0068
The XLogP value of 3.07651 indicates that F0475-0068 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.85 Ų falls within the moderate polarity range, balancing permeability and solubility for F0475-0068. Following Lipinski's Rule of Five, F0475-0068 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 F0475-0068?
The CAS number of F0475-0068 is 391886-55-8.
What is the molecular formula of F0475-0068?
The molecular formula of F0475-0068 is C17H15N5O3S.
What is the molecular weight of F0475-0068?
The molecular weight of F0475-0068 is 369.09 g/mol.
Where can I buy F0475-0068?
You can request a quote for F0475-0068 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0475-0068?
Yes, KEHONG BIO provides custom synthesis services for F0475-0068 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.