AN-989/42063691
TL;DR: AN-989/42063691 (CAS 428476-63-5) is a chemical compound with molecular formula C20H26N2O5S2 and molecular weight 438.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxy-N-methylsulfonylanilino)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide
Also Known As: AN-989/42063691, 2-(3,4-dimethoxy-N-methylsulfonylanilino)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide, 2-[3,4-dimethoxy(methylsulfonyl)anilino]-N-{2-[(4-methylphenyl)sulfanyl]ethyl}acetamide, N~2~-(3,4-dimethoxyphenyl)-N-{2-[(4-methylphenyl)sulfanyl]ethyl}-N~2~-(methylsulfonyl)glycinamide
| Molecular Formula | C20H26N2O5S2 |
|---|---|
| Molecular Weight | 438.13 g/mol |
| LogP | 2.68672 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 438.12833 |
| Heavy Atoms | 29 |
| Complexity | 930.38776 |
Chemical Identifiers
| CAS Number | 428476-63-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCCNC(=O)CN(C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C |
Product Overview
AN-989/42063691 (CAS 428476-63-5), with molecular formula C20H26N2O5S2 and molecular weight 438.13 g/mol. IUPAC: 2-(3,4-dimethoxy-N-methylsulfonylanilino)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide.
Chemical Property Profile of AN-989/42063691
Property Insights of AN-989/42063691
The XLogP value of 2.68672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-989/42063691. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-989/42063691. Following Lipinski's Rule of Five, AN-989/42063691 has 1 hydrogen bond donor(s) and 6 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-989/42063691?
The CAS number of AN-989/42063691 is 428476-63-5.
What is the molecular formula of AN-989/42063691?
The molecular formula of AN-989/42063691 is C20H26N2O5S2.
What is the molecular weight of AN-989/42063691?
The molecular weight of AN-989/42063691 is 438.13 g/mol.
Where can I buy AN-989/42063691?
You can request a quote for AN-989/42063691 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-989/42063691?
Yes, KEHONG BIO provides custom synthesis services for AN-989/42063691 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.