ChemDiv1_024494
TL;DR: ChemDiv1_024494 (CAS 381691-63-0) is a chemical compound with molecular formula C23H17ClN2O4 and molecular weight 420.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(3-chlorophenyl)-4-[hydroxy-(4-methoxyphenyl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione
Also Known As: ChemDiv1_024494, 5-(3-chlorophenyl)-3-hydroxy-4-(4-methoxybenzoyl)-1-(pyridin-2-yl)-1H-pyrrol-2(5H)-one, (4E)-5-(3-chlorophenyl)-4-[hydroxy-(4-methoxyphenyl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione, (E)-[2-(3-chlorophenyl)-4,5-dioxo-1-(pyridinium-2-yl)pyrrolidin-3-ylidene](4-methoxyphenyl)methanolate, 5-(3-CHLOROPHENYL)-3-HYDROXY-4-(4-METHOXYBENZOYL)-1-(PYRIDIN-2-YL)-2,5-DIHYDRO-1H-PYRROL-2-ONE
| Molecular Formula | C23H17ClN2O4 |
|---|---|
| Molecular Weight | 420.09 g/mol |
| LogP | 4.3699 |
| Topological Polar Surface Area | 79.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.08768 |
| Heavy Atoms | 30 |
| Complexity | 1143.3794 |
Chemical Identifiers
| CAS Number | 381691-63-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC=CC=N3)C4=CC(=CC=C4)Cl)/O |
Product Overview
ChemDiv1_024494 (CAS 381691-63-0), with molecular formula C23H17ClN2O4 and molecular weight 420.09 g/mol. IUPAC: (4E)-5-(3-chlorophenyl)-4-[hydroxy-(4-methoxyphenyl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of ChemDiv1_024494
Property Insights of ChemDiv1_024494
The XLogP value of 4.3699 indicates that ChemDiv1_024494 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.73 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_024494. Following Lipinski's Rule of Five, ChemDiv1_024494 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 ChemDiv1_024494?
The CAS number of ChemDiv1_024494 is 381691-63-0.
What is the molecular formula of ChemDiv1_024494?
The molecular formula of ChemDiv1_024494 is C23H17ClN2O4.
What is the molecular weight of ChemDiv1_024494?
The molecular weight of ChemDiv1_024494 is 420.09 g/mol.
Where can I buy ChemDiv1_024494?
You can request a quote for ChemDiv1_024494 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_024494?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_024494 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.