AO-081/40680976
TL;DR: AO-081/40680976 (CAS 433239-50-0) is a chemical compound with molecular formula C22H20Cl2N2O3S and molecular weight 462.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]-N-[(2-chlorophenyl)methyl]acetamide
Also Known As: AO-081/40680976, 2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]-N-[(2-chlorophenyl)methyl]acetamide, N-(2-chlorobenzyl)-2-[(4-chlorobenzyl)(phenylsulfonyl)amino]acetamide, N-(2-chlorobenzyl)-N~2~-(4-chlorobenzyl)-N~2~-(phenylsulfonyl)glycinamide
| Molecular Formula | C22H20Cl2N2O3S |
|---|---|
| Molecular Weight | 462.06 g/mol |
| LogP | 4.5007 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 462.05716 |
| Heavy Atoms | 30 |
| Complexity | 1104.7412 |
Chemical Identifiers
| CAS Number | 433239-50-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Cl)CC(=O)NCC3=CC=CC=C3Cl |
Product Overview
AO-081/40680976 (CAS 433239-50-0), with molecular formula C22H20Cl2N2O3S and molecular weight 462.06 g/mol. IUPAC: 2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]-N-[(2-chlorophenyl)methyl]acetamide.
Chemical Property Profile of AO-081/40680976
Property Insights of AO-081/40680976
The XLogP value of 4.5007 indicates that AO-081/40680976 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/40680976. Following Lipinski's Rule of Five, AO-081/40680976 has 1 hydrogen bond donor(s) and 3 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 AO-081/40680976?
The CAS number of AO-081/40680976 is 433239-50-0.
What is the molecular formula of AO-081/40680976?
The molecular formula of AO-081/40680976 is C22H20Cl2N2O3S.
What is the molecular weight of AO-081/40680976?
The molecular weight of AO-081/40680976 is 462.06 g/mol.
Where can I buy AO-081/40680976?
You can request a quote for AO-081/40680976 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/40680976?
Yes, KEHONG BIO provides custom synthesis services for AO-081/40680976 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.