BAS 01247810
TL;DR: BAS 01247810 (CAS 489402-69-9) is a chemical compound with molecular formula C21H14ClN3O3 and molecular weight 391.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(2-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-pyrimidin-2-ylpyrrolidine-2,3-dione
Also Known As: BAS 01247810, 4-benzoyl-5-(2-chlorophenyl)-3-hydroxy-1-(pyrimidin-2-yl)-1H-pyrrol-2(5H)-one, (4E)-5-(2-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-pyrimidin-2-ylpyrrolidine-2,3-dione, (E)-[2-(2-chlorophenyl)-4,5-dioxo-1-(pyrimidin-1-ium-2-yl)pyrrolidin-3-ylidene](phenyl)methanolate
| Molecular Formula | C21H14ClN3O3 |
|---|---|
| Molecular Weight | 391.07 g/mol |
| LogP | 3.7563 |
| Topological Polar Surface Area | 83.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.07236 |
| Heavy Atoms | 28 |
| Complexity | 1084.3196 |
Chemical Identifiers
| CAS Number | 489402-69-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC=CC=N3)C4=CC=CC=C4Cl)/O |
Product Overview
BAS 01247810 (CAS 489402-69-9), with molecular formula C21H14ClN3O3 and molecular weight 391.07 g/mol. IUPAC: (4E)-5-(2-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-pyrimidin-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 01247810
Property Insights of BAS 01247810
The XLogP value of 3.7563 indicates that BAS 01247810 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01247810. Following Lipinski's Rule of Five, BAS 01247810 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 BAS 01247810?
The CAS number of BAS 01247810 is 489402-69-9.
What is the molecular formula of BAS 01247810?
The molecular formula of BAS 01247810 is C21H14ClN3O3.
What is the molecular weight of BAS 01247810?
The molecular weight of BAS 01247810 is 391.07 g/mol.
Where can I buy BAS 01247810?
You can request a quote for BAS 01247810 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01247810?
Yes, KEHONG BIO provides custom synthesis services for BAS 01247810 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.