AO-081/41133494
TL;DR: AO-081/41133494 (CAS 499112-84-4) is a chemical compound with molecular formula C19H22BrClN2O3S and molecular weight 472.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)methyl-(4-chlorophenyl)sulfonylamino]-N-(2-methylpropyl)acetamide
Also Known As: AO-081/41133494, 2-[(4-bromophenyl)methyl-(4-chlorophenyl)sulfonylamino]-N-(2-methylpropyl)acetamide, N~2~-(4-bromobenzyl)-N~2~-[(4-chlorophenyl)sulfonyl]-N-(2-methylpropyl)glycinamide, 2-{(4-bromobenzyl)[(4-chlorophenyl)sulfonyl]amino}-N-isobutylacetamide, 2-{N-[(4-bromophenyl)methyl]-4-chlorobenzenesulfonamido}-N-(2-methylpropyl)acetamide
| Molecular Formula | C19H22BrClN2O3S |
|---|---|
| Molecular Weight | 472.02 g/mol |
| LogP | 4.0656 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 472.0223 |
| Heavy Atoms | 27 |
| Complexity | 868.8327 |
Chemical Identifiers
| CAS Number | 499112-84-4 |
|---|---|
| SMILES | CC(C)CNC(=O)CN(CC1=CC=C(C=C1)Br)S(=O)(=O)C2=CC=C(C=C2)Cl |
Product Overview
AO-081/41133494 (CAS 499112-84-4), with molecular formula C19H22BrClN2O3S and molecular weight 472.02 g/mol. IUPAC: 2-[(4-bromophenyl)methyl-(4-chlorophenyl)sulfonylamino]-N-(2-methylpropyl)acetamide.
Chemical Property Profile of AO-081/41133494
Property Insights of AO-081/41133494
The XLogP value of 4.0656 indicates that AO-081/41133494 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-081/41133494. Following Lipinski's Rule of Five, AO-081/41133494 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-081/41133494?
The CAS number of AO-081/41133494 is 499112-84-4.
What is the molecular formula of AO-081/41133494?
The molecular formula of AO-081/41133494 is C19H22BrClN2O3S.
What is the molecular weight of AO-081/41133494?
The molecular weight of AO-081/41133494 is 472.02 g/mol.
Where can I buy AO-081/41133494?
You can request a quote for AO-081/41133494 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/41133494?
Yes, KEHONG BIO provides custom synthesis services for AO-081/41133494 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.