AO-081/40838423
TL;DR: AO-081/40838423 (CAS 431981-18-9) is a chemical compound with molecular formula C26H29N3O3S and molecular weight 463.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dimethylphenyl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide
Also Known As: AO-081/40838423, N-(2,3-dimethylphenyl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide, N-(2,3-dimethylphenyl)-N-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]benzenesulfonamide
| Molecular Formula | C26H29N3O3S |
|---|---|
| Molecular Weight | 463.19 g/mol |
| LogP | 3.84754 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.19296 |
| Heavy Atoms | 33 |
| Complexity | 1206.0442 |
Chemical Identifiers
| CAS Number | 431981-18-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N(CC(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C |
Product Overview
AO-081/40838423 (CAS 431981-18-9), with molecular formula C26H29N3O3S and molecular weight 463.19 g/mol. IUPAC: N-(2,3-dimethylphenyl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide.
Chemical Property Profile of AO-081/40838423
Property Insights of AO-081/40838423
The XLogP value of 3.84754 indicates that AO-081/40838423 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-081/40838423. Following Lipinski's Rule of Five, AO-081/40838423 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-081/40838423?
The CAS number of AO-081/40838423 is 431981-18-9.
What is the molecular formula of AO-081/40838423?
The molecular formula of AO-081/40838423 is C26H29N3O3S.
What is the molecular weight of AO-081/40838423?
The molecular weight of AO-081/40838423 is 463.19 g/mol.
Where can I buy AO-081/40838423?
You can request a quote for AO-081/40838423 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/40838423?
Yes, KEHONG BIO provides custom synthesis services for AO-081/40838423 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.