A2101/0088287
TL;DR: A2101/0088287 (CAS 314735-58-5) is a chemical compound with molecular formula C23H17ClN2O3 and molecular weight 404.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-chlorophenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione
Also Known As: A2101/0088287, 5-(4-chlorophenyl)-3-hydroxy-4-[(4-methylphenyl)carbonyl]-1-(pyridin-2-yl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-5-(4-chlorophenyl)-4-[hydroxy(4-methylphenyl)methylidene]-1-(pyridin-2-yl)pyrrolidine-2,3-dione, (4E)-5-(4-chlorophenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione, 5-(4-CHLOROPHENYL)-3-HYDROXY-4-(4-METHYLBENZOYL)-1-(PYRIDIN-2-YL)-2,5-DIHYDRO-1H-PYRROL-2-ONE
| Molecular Formula | C23H17ClN2O3 |
|---|---|
| Molecular Weight | 404.09 g/mol |
| LogP | 4.66972 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.09277 |
| Heavy Atoms | 29 |
| Complexity | 1107.1246 |
Chemical Identifiers
| CAS Number | 314735-58-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC=CC=N3)C4=CC=C(C=C4)Cl)/O |
Product Overview
A2101/0088287 (CAS 314735-58-5), with molecular formula C23H17ClN2O3 and molecular weight 404.09 g/mol. IUPAC: (4E)-5-(4-chlorophenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of A2101/0088287
Property Insights of A2101/0088287
The XLogP value of 4.66972 indicates that A2101/0088287 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for A2101/0088287. Following Lipinski's Rule of Five, A2101/0088287 has 1 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 A2101/0088287?
The CAS number of A2101/0088287 is 314735-58-5.
What is the molecular formula of A2101/0088287?
The molecular formula of A2101/0088287 is C23H17ClN2O3.
What is the molecular weight of A2101/0088287?
The molecular weight of A2101/0088287 is 404.09 g/mol.
Where can I buy A2101/0088287?
You can request a quote for A2101/0088287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2101/0088287?
Yes, KEHONG BIO provides custom synthesis services for A2101/0088287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.