A3842/0163177
TL;DR: A3842/0163177 (CAS 462069-92-7) is a chemical compound with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[hydroxy(phenyl)methylidene]-5-(4-methoxyphenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,3-dione
Also Known As: A3842/0163177, 4-[hydroxy(phenyl)methylidene]-5-(4-methoxyphenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,3-dione, 4-benzoyl-3-hydroxy-5-(4-methoxyphenyl)-1-[2-(piperazin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-2-one
| Molecular Formula | C24H27N3O4 |
|---|---|
| Molecular Weight | 421.20 g/mol |
| LogP | 2.0221 |
| Topological Polar Surface Area | 82.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.20016 |
| Heavy Atoms | 31 |
| Complexity | 966.07874 |
Chemical Identifiers
| CAS Number | 462069-92-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2CCN4CCNCC4 |
Product Overview
A3842/0163177 (CAS 462069-92-7), with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol. IUPAC: 4-[hydroxy(phenyl)methylidene]-5-(4-methoxyphenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of A3842/0163177
Property Insights of A3842/0163177
The XLogP value of 2.0221 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3842/0163177. The TPSA of 82.11 Ų falls within the moderate polarity range, balancing permeability and solubility for A3842/0163177. Following Lipinski's Rule of Five, A3842/0163177 has 2 hydrogen bond donor(s) and 6 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 A3842/0163177?
The CAS number of A3842/0163177 is 462069-92-7.
What is the molecular formula of A3842/0163177?
The molecular formula of A3842/0163177 is C24H27N3O4.
What is the molecular weight of A3842/0163177?
The molecular weight of A3842/0163177 is 421.20 g/mol.
Where can I buy A3842/0163177?
You can request a quote for A3842/0163177 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3842/0163177?
Yes, KEHONG BIO provides custom synthesis services for A3842/0163177 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.