AP-970/42165918
TL;DR: AP-970/42165918 (CAS 708293-27-0) is a chemical compound with molecular formula C19H21FN4OS and molecular weight 372.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-ethoxyphenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine
Also Known As: AP-970/42165918, N-(4-ethoxybenzyl)-N-{3-[(2-fluorobenzyl)thio]-5-methyl-4H-1,2,4-triazol-4-yl}amine, N-[(4-ethoxyphenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine, (4-Ethoxy-benzyl)-[3-(2-fluoro-benzylsulfanyl)-5-methyl-[1,2,4]triazol-4-yl]-amine
| Molecular Formula | C19H21FN4OS |
|---|---|
| Molecular Weight | 372.14 g/mol |
| LogP | 4.16032 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 372.142 |
| Heavy Atoms | 26 |
| Complexity | 851.00037 |
Chemical Identifiers
| CAS Number | 708293-27-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CNN2C(=NN=C2SCC3=CC=CC=C3F)C |
Product Overview
AP-970/42165918 (CAS 708293-27-0), with molecular formula C19H21FN4OS and molecular weight 372.14 g/mol. IUPAC: N-[(4-ethoxyphenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine.
Chemical Property Profile of AP-970/42165918
Property Insights of AP-970/42165918
The XLogP value of 4.16032 indicates that AP-970/42165918 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.97 Ų, AP-970/42165918 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AP-970/42165918 has 1 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 AP-970/42165918?
The CAS number of AP-970/42165918 is 708293-27-0.
What is the molecular formula of AP-970/42165918?
The molecular formula of AP-970/42165918 is C19H21FN4OS.
What is the molecular weight of AP-970/42165918?
The molecular weight of AP-970/42165918 is 372.14 g/mol.
Where can I buy AP-970/42165918?
You can request a quote for AP-970/42165918 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42165918?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42165918 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.