AP-970/42165974
TL;DR: AP-970/42165974 (CAS 708288-68-0) is a chemical compound with molecular formula C15H15FN4S2 and molecular weight 334.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-fluorophenyl)methylsulfanyl]-N-[(3-methylthiophen-2-yl)methyl]-1,2,4-triazol-4-amine
Also Known As: AP-970/42165974, 3-[(2-fluorobenzyl)sulfanyl]-N-[(3-methylthiophen-2-yl)methyl]-4H-1,2,4-triazol-4-amine, 3-[(2-fluorophenyl)methylsulfanyl]-N-[(3-methylthiophen-2-yl)methyl]-1,2,4-triazol-4-amine, [3-(2-Fluoro-benzylsulfanyl)-[1,2,4]triazol-4-yl]-(3-methyl-thiophen-2-ylmethyl)-amine, 3-[(2-fluorobenzyl)thio]-N-[(3-methyl-2-thienyl)methyl]-4H-1,2,4-triazol-4-amine
| Molecular Formula | C15H15FN4S2 |
|---|---|
| Molecular Weight | 334.07 g/mol |
| LogP | 3.82312 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.0722 |
| Heavy Atoms | 22 |
| Complexity | 753.3477 |
Chemical Identifiers
| CAS Number | 708288-68-0 |
|---|---|
| SMILES | CC1=C(SC=C1)CNN2C=NN=C2SCC3=CC=CC=C3F |
Product Overview
AP-970/42165974 (CAS 708288-68-0), with molecular formula C15H15FN4S2 and molecular weight 334.07 g/mol. IUPAC: 3-[(2-fluorophenyl)methylsulfanyl]-N-[(3-methylthiophen-2-yl)methyl]-1,2,4-triazol-4-amine.
Chemical Property Profile of AP-970/42165974
Property Insights of AP-970/42165974
The XLogP value of 3.82312 indicates that AP-970/42165974 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.74 Ų, AP-970/42165974 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AP-970/42165974 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-970/42165974?
The CAS number of AP-970/42165974 is 708288-68-0.
What is the molecular formula of AP-970/42165974?
The molecular formula of AP-970/42165974 is C15H15FN4S2.
What is the molecular weight of AP-970/42165974?
The molecular weight of AP-970/42165974 is 334.07 g/mol.
Where can I buy AP-970/42165974?
You can request a quote for AP-970/42165974 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42165974?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42165974 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.