AF-399/14945092
TL;DR: AF-399/14945092 (CAS 315234-99-2) is a chemical compound with molecular formula C22H22O3S2 and molecular weight 398.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)sulfanyl-1-thiophen-2-ylpropan-1-one
Also Known As: AF-399/14945092, 3-(3,4-dimethoxyphenyl)-3-[(4-methylphenyl)sulfanyl]-1-(thiophen-2-yl)propan-1-one, 3-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)sulfanyl-1-thiophen-2-ylpropan-1-one, 3-(3,4-dimethoxyphenyl)-3-(4-methylphenylthio)-1-(2-thienyl)propan-1-one, 3-(3,4-dimethoxyphenyl)-3-[(4-methylphenyl)sulfanyl]-1-(2-thienyl)-1-propanone
| Molecular Formula | C22H22O3S2 |
|---|---|
| Molecular Weight | 398.10 g/mol |
| LogP | 6.18012 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 398.10104 |
| Heavy Atoms | 27 |
| Complexity | 886.43115 |
Chemical Identifiers
| CAS Number | 315234-99-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC(CC(=O)C2=CC=CS2)C3=CC(=C(C=C3)OC)OC |
Product Overview
AF-399/14945092 (CAS 315234-99-2), with molecular formula C22H22O3S2 and molecular weight 398.10 g/mol. IUPAC: 3-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)sulfanyl-1-thiophen-2-ylpropan-1-one.
Chemical Property Profile of AF-399/14945092
Property Insights of AF-399/14945092
The XLogP value of 6.18012 indicates that AF-399/14945092 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, AF-399/14945092 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/14945092 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/14945092?
The CAS number of AF-399/14945092 is 315234-99-2.
What is the molecular formula of AF-399/14945092?
The molecular formula of AF-399/14945092 is C22H22O3S2.
What is the molecular weight of AF-399/14945092?
The molecular weight of AF-399/14945092 is 398.10 g/mol.
Where can I buy AF-399/14945092?
You can request a quote for AF-399/14945092 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/14945092?
Yes, KEHONG BIO provides custom synthesis services for AF-399/14945092 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.