AO-081/41133928
TL;DR: AO-081/41133928 (CAS 593256-01-0) is a chemical compound with molecular formula C20H22Cl3N3O3S and molecular weight 489.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(2,6-dichlorophenyl)methyl]-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide
Also Known As: AO-081/41133928, 4-chloro-N-(2,6-dichlorobenzyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide, 4-chloro-N-[(2,6-dichlorophenyl)methyl]-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide
| Molecular Formula | C20H22Cl3N3O3S |
|---|---|
| Molecular Weight | 489.04 g/mol |
| LogP | 3.6117 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 489.04474 |
| Heavy Atoms | 30 |
| Complexity | 987.4519 |
Chemical Identifiers
| CAS Number | 593256-01-0 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)CN(CC2=C(C=CC=C2Cl)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
AO-081/41133928 (CAS 593256-01-0), with molecular formula C20H22Cl3N3O3S and molecular weight 489.04 g/mol. IUPAC: 4-chloro-N-[(2,6-dichlorophenyl)methyl]-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide.
Chemical Property Profile of AO-081/41133928
Property Insights of AO-081/41133928
The XLogP value of 3.6117 indicates that AO-081/41133928 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/41133928. Following Lipinski's Rule of Five, AO-081/41133928 has 0 hydrogen bond donor(s) and 4 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-081/41133928?
The CAS number of AO-081/41133928 is 593256-01-0.
What is the molecular formula of AO-081/41133928?
The molecular formula of AO-081/41133928 is C20H22Cl3N3O3S.
What is the molecular weight of AO-081/41133928?
The molecular weight of AO-081/41133928 is 489.04 g/mol.
Where can I buy AO-081/41133928?
You can request a quote for AO-081/41133928 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/41133928?
Yes, KEHONG BIO provides custom synthesis services for AO-081/41133928 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.