AO-081/13878393
TL;DR: AO-081/13878393 (CAS 496935-82-1) is a chemical compound with molecular formula C24H31N3O7S and molecular weight 505.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(3,4-dimethoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate
Also Known As: AO-081/13878393, ethyl 4-[2-(3,4-dimethoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate, ethyl 4-{N-(3,4-dimethoxyphenyl)-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate, ethyl 4-({3,4-dimethoxy[(4-methylphenyl)sulfonyl]anilino}acetyl)piperazine-1-carboxylate, ethyl 4-(2-(N-(3,4-dimethoxyphenyl)-4-methylphenylsulfonamido)acetyl)piperazine-1-carboxylate
| Molecular Formula | C24H31N3O7S |
|---|---|
| Molecular Weight | 505.19 g/mol |
| LogP | 2.50822 |
| Topological Polar Surface Area | 105.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 505.18826 |
| Heavy Atoms | 35 |
| Complexity | 1144.2078 |
Chemical Identifiers
| CAS Number | 496935-82-1 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=C(C=C3)C |
Product Overview
AO-081/13878393 (CAS 496935-82-1), with molecular formula C24H31N3O7S and molecular weight 505.19 g/mol. IUPAC: ethyl 4-[2-(3,4-dimethoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate.
Chemical Property Profile of AO-081/13878393
Property Insights of AO-081/13878393
The XLogP value of 2.50822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-081/13878393. The TPSA of 105.69 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/13878393. Following Lipinski's Rule of Five, AO-081/13878393 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-081/13878393?
The CAS number of AO-081/13878393 is 496935-82-1.
What is the molecular formula of AO-081/13878393?
The molecular formula of AO-081/13878393 is C24H31N3O7S.
What is the molecular weight of AO-081/13878393?
The molecular weight of AO-081/13878393 is 505.19 g/mol.
Where can I buy AO-081/13878393?
You can request a quote for AO-081/13878393 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/13878393?
Yes, KEHONG BIO provides custom synthesis services for AO-081/13878393 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.