AO-081/15572401
TL;DR: AO-081/15572401 (CAS 488102-26-7) is a chemical compound with molecular formula C21H25BrN4O4S and molecular weight 508.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl]-N'-(4-bromo-3-methylphenyl)oxamide
Also Known As: AO-081/15572401, N-[2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl]-N'-(4-bromo-3-methylphenyl)oxamide, N-(4-bromo-3-methylphenyl)-N'-{2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl}ethanediamide, N1-(4-bromo-3-methylphenyl)-N2-(2-(4-(phenylsulfonyl)piperazin-1-yl)ethyl)oxalamide, N~1~-(4-bromo-3-methylphenyl)-N~2~-{2-[4-(phenylsulfonyl)-1-piperazinyl]ethyl}ethanediamide
| Molecular Formula | C21H25BrN4O4S |
|---|---|
| Molecular Weight | 508.08 g/mol |
| LogP | 1.81872 |
| Topological Polar Surface Area | 98.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 508.078 |
| Heavy Atoms | 31 |
| Complexity | 1038.6002 |
Chemical Identifiers
| CAS Number | 488102-26-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NC(=O)C(=O)NCCN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)Br |
Product Overview
AO-081/15572401 (CAS 488102-26-7), with molecular formula C21H25BrN4O4S and molecular weight 508.08 g/mol. IUPAC: N-[2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl]-N'-(4-bromo-3-methylphenyl)oxamide.
Chemical Property Profile of AO-081/15572401
Property Insights of AO-081/15572401
The XLogP value of 1.81872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-081/15572401. The TPSA of 98.82 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/15572401. Following Lipinski's Rule of Five, AO-081/15572401 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-081/15572401?
The CAS number of AO-081/15572401 is 488102-26-7.
What is the molecular formula of AO-081/15572401?
The molecular formula of AO-081/15572401 is C21H25BrN4O4S.
What is the molecular weight of AO-081/15572401?
The molecular weight of AO-081/15572401 is 508.08 g/mol.
Where can I buy AO-081/15572401?
You can request a quote for AO-081/15572401 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15572401?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15572401 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.