AF-399/12925010
TL;DR: AF-399/12925010 (CAS 324779-56-8) is a chemical compound with molecular formula C23H18ClN3S and molecular weight 403.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole
Also Known As: AF-399/12925010, 3-(3-chlorophenyl)-4-phenyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole, 3-(3-chlorophenyl)-5-(cinnamylthio)-4-phenyl-4H-1,2,4-triazole, 5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl cinnamyl sulfide, 3-((2E)-3-phenylprop-2-enylthio)-5-(3-chlorophenyl)-4-phenyl-1,2,4-triazole
| Molecular Formula | C23H18ClN3S |
|---|---|
| Molecular Weight | 403.09 g/mol |
| LogP | 6.3932 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.091 |
| Heavy Atoms | 28 |
| Complexity | 1075.4749 |
Chemical Identifiers
| CAS Number | 324779-56-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/CSC2=NN=C(N2C3=CC=CC=C3)C4=CC(=CC=C4)Cl |
Product Overview
AF-399/12925010 (CAS 324779-56-8), with molecular formula C23H18ClN3S and molecular weight 403.09 g/mol. IUPAC: 3-(3-chlorophenyl)-4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole.
Chemical Property Profile of AF-399/12925010
Property Insights of AF-399/12925010
The XLogP value of 6.3932 indicates that AF-399/12925010 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, AF-399/12925010 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/12925010 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/12925010?
The CAS number of AF-399/12925010 is 324779-56-8.
What is the molecular formula of AF-399/12925010?
The molecular formula of AF-399/12925010 is C23H18ClN3S.
What is the molecular weight of AF-399/12925010?
The molecular weight of AF-399/12925010 is 403.09 g/mol.
Where can I buy AF-399/12925010?
You can request a quote for AF-399/12925010 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/12925010?
Yes, KEHONG BIO provides custom synthesis services for AF-399/12925010 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.