AO-081/40671799
TL;DR: AO-081/40671799 (CAS 498532-52-8) is a chemical compound with molecular formula C25H26ClN3O3S and molecular weight 483.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methyl]-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide
Also Known As: AO-081/40671799, N-[(4-chlorophenyl)methyl]-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide, N-(4-chlorobenzyl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide, N-(4-chlorobenzyl)-N-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]benzenesulfonamide
| Molecular Formula | C25H26ClN3O3S |
|---|---|
| Molecular Weight | 483.14 g/mol |
| LogP | 3.8797 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 483.13834 |
| Heavy Atoms | 33 |
| Complexity | 1164.5386 |
Chemical Identifiers
| CAS Number | 498532-52-8 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)C(=O)CN(CC3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC=C4 |
Product Overview
AO-081/40671799 (CAS 498532-52-8), with molecular formula C25H26ClN3O3S and molecular weight 483.14 g/mol. IUPAC: N-[(4-chlorophenyl)methyl]-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide.
Chemical Property Profile of AO-081/40671799
Property Insights of AO-081/40671799
The XLogP value of 3.8797 indicates that AO-081/40671799 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-081/40671799. Following Lipinski's Rule of Five, AO-081/40671799 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-081/40671799?
The CAS number of AO-081/40671799 is 498532-52-8.
What is the molecular formula of AO-081/40671799?
The molecular formula of AO-081/40671799 is C25H26ClN3O3S.
What is the molecular weight of AO-081/40671799?
The molecular weight of AO-081/40671799 is 483.14 g/mol.
Where can I buy AO-081/40671799?
You can request a quote for AO-081/40671799 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/40671799?
Yes, KEHONG BIO provides custom synthesis services for AO-081/40671799 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.