AO-081/41130927
TL;DR: AO-081/41130927 (CAS 593255-79-9) is a chemical compound with molecular formula C22H18ClFN2O5S and molecular weight 476.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[(4-chlorophenyl)sulfonyl-[(2-fluorophenyl)methyl]amino]acetamide
Also Known As: AO-081/41130927, N-(1,3-benzodioxol-5-yl)-2-[(4-chlorophenyl)sulfonyl-[(2-fluorophenyl)methyl]amino]acetamide, N-1,3-benzodioxol-5-yl-N~2~-[(4-chlorophenyl)sulfonyl]-N~2~-(2-fluorobenzyl)glycinamide, N-(1,3-benzodioxol-5-yl)-2-[[(4-chlorophenyl)sulfonyl](2-fluorobenzyl)amino]acetamide, N-(2H-1,3-benzodioxol-5-yl)-2-{N-[(2-fluorophenyl)methyl]-4-chlorobenzenesulfonamido}acetamide
| Molecular Formula | C22H18ClFN2O5S |
|---|---|
| Molecular Weight | 476.06 g/mol |
| LogP | 4.0374 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 476.0609 |
| Heavy Atoms | 32 |
| Complexity | 1251.4309 |
Chemical Identifiers
| CAS Number | 593255-79-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)CN(CC3=CC=CC=C3F)S(=O)(=O)C4=CC=C(C=C4)Cl |
Product Overview
AO-081/41130927 (CAS 593255-79-9), with molecular formula C22H18ClFN2O5S and molecular weight 476.06 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[(4-chlorophenyl)sulfonyl-[(2-fluorophenyl)methyl]amino]acetamide.
Chemical Property Profile of AO-081/41130927
Property Insights of AO-081/41130927
The XLogP value of 4.0374 indicates that AO-081/41130927 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/41130927. Following Lipinski's Rule of Five, AO-081/41130927 has 1 hydrogen bond donor(s) and 5 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-081/41130927?
The CAS number of AO-081/41130927 is 593255-79-9.
What is the molecular formula of AO-081/41130927?
The molecular formula of AO-081/41130927 is C22H18ClFN2O5S.
What is the molecular weight of AO-081/41130927?
The molecular weight of AO-081/41130927 is 476.06 g/mol.
Where can I buy AO-081/41130927?
You can request a quote for AO-081/41130927 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/41130927?
Yes, KEHONG BIO provides custom synthesis services for AO-081/41130927 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.