ChemDiv2_003978
TL;DR: ChemDiv2_003978 (CAS 371213-01-3) 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.
(4E)-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-phenyl-1-(2-piperazin-1-ylethyl)pyrrolidine-2,3-dione
Also Known As: ChemDiv2_003978, AS-871/41319558, 3-hydroxy-4-(4-methoxybenzoyl)-5-phenyl-1-[2-(1-piperazinyl)ethyl]-1,5-dihydro-2H-pyrrol-2-one, 3-hydroxy-4-(4-methoxybenzoyl)-5-phenyl-1-(2-(piperazin-1-yl)ethyl)-1H-pyrrol-2(5H)-one, (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-phenyl-1-[2-(piperazin-1-yl)ethyl]pyrrolidine-2,3-dione
| 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 | 371213-01-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCN3CCNCC3)C4=CC=CC=C4)/O |
Product Overview
ChemDiv2_003978 (CAS 371213-01-3), with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol. IUPAC: (4E)-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-phenyl-1-(2-piperazin-1-ylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of ChemDiv2_003978
Property Insights of ChemDiv2_003978
The XLogP value of 2.0221 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_003978. The TPSA of 82.11 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_003978. Following Lipinski's Rule of Five, ChemDiv2_003978 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 ChemDiv2_003978?
The CAS number of ChemDiv2_003978 is 371213-01-3.
What is the molecular formula of ChemDiv2_003978?
The molecular formula of ChemDiv2_003978 is C24H27N3O4.
What is the molecular weight of ChemDiv2_003978?
The molecular weight of ChemDiv2_003978 is 421.20 g/mol.
Where can I buy ChemDiv2_003978?
You can request a quote for ChemDiv2_003978 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_003978?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_003978 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.