AN-465/41991093
TL;DR: AN-465/41991093 (CAS 695170-83-3) is a chemical compound with molecular formula C18H19FN4S and molecular weight 342.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-ethylphenyl)methyl]-3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine
Also Known As: AN-465/41991093, N-[(4-ethylphenyl)methyl]-3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine, N-(4-ethylbenzyl)-N-{3-[(4-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-4-yl}amine
| Molecular Formula | C18H19FN4S |
|---|---|
| Molecular Weight | 342.13 g/mol |
| LogP | 4.0156 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 342.13144 |
| Heavy Atoms | 24 |
| Complexity | 768.47266 |
Chemical Identifiers
| CAS Number | 695170-83-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=C(C=C3)F |
Product Overview
AN-465/41991093 (CAS 695170-83-3), with molecular formula C18H19FN4S and molecular weight 342.13 g/mol. IUPAC: N-[(4-ethylphenyl)methyl]-3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine.
Chemical Property Profile of AN-465/41991093
Property Insights of AN-465/41991093
The XLogP value of 4.0156 indicates that AN-465/41991093 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.74 Ų, AN-465/41991093 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-465/41991093 has 1 hydrogen bond donor(s) and 4 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 AN-465/41991093?
The CAS number of AN-465/41991093 is 695170-83-3.
What is the molecular formula of AN-465/41991093?
The molecular formula of AN-465/41991093 is C18H19FN4S.
What is the molecular weight of AN-465/41991093?
The molecular weight of AN-465/41991093 is 342.13 g/mol.
Where can I buy AN-465/41991093?
You can request a quote for AN-465/41991093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41991093?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41991093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.