AO-081/15569073
TL;DR: AO-081/15569073 (CAS 496940-48-8) is a chemical compound with molecular formula C23H27ClN4O3 and molecular weight 442.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(4-chlorophenyl)methyl]-N-[2-[4-(4-methylbenzoyl)piperazin-1-yl]ethyl]oxamide
Also Known As: AO-081/15569073, N'-[(4-chlorophenyl)methyl]-N-[2-[4-(4-methylbenzoyl)piperazin-1-yl]ethyl]oxamide, N-(4-chlorobenzyl)-N'-(2-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}ethyl)ethanediamide, N~1~-(4-chlorobenzyl)-N~2~-{2-[4-(4-methylbenzoyl)-1-piperazinyl]ethyl}ethanediamide, N1-(4-chlorobenzyl)-N2-(2-(4-(4-methylbenzoyl)piperazin-1-yl)ethyl)oxalamide
| Molecular Formula | C23H27ClN4O3 |
|---|---|
| Molecular Weight | 442.18 g/mol |
| LogP | 1.83882 |
| Topological Polar Surface Area | 81.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.17715 |
| Heavy Atoms | 31 |
| Complexity | 907.42377 |
Chemical Identifiers
| CAS Number | 496940-48-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C(=O)NCC3=CC=C(C=C3)Cl |
Product Overview
AO-081/15569073 (CAS 496940-48-8), with molecular formula C23H27ClN4O3 and molecular weight 442.18 g/mol. IUPAC: N'-[(4-chlorophenyl)methyl]-N-[2-[4-(4-methylbenzoyl)piperazin-1-yl]ethyl]oxamide.
Chemical Property Profile of AO-081/15569073
Property Insights of AO-081/15569073
The XLogP value of 1.83882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-081/15569073. The TPSA of 81.75 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/15569073. Following Lipinski's Rule of Five, AO-081/15569073 has 2 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-081/15569073?
The CAS number of AO-081/15569073 is 496940-48-8.
What is the molecular formula of AO-081/15569073?
The molecular formula of AO-081/15569073 is C23H27ClN4O3.
What is the molecular weight of AO-081/15569073?
The molecular weight of AO-081/15569073 is 442.18 g/mol.
Where can I buy AO-081/15569073?
You can request a quote for AO-081/15569073 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15569073?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15569073 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.