BAS 01247816
TL;DR: BAS 01247816 (CAS 332170-06-6) is a chemical compound with molecular formula C21H14FN3O3 and molecular weight 375.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(3-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-pyrimidin-2-ylpyrrolidine-2,3-dione
Also Known As: BAS 01247816, 4-benzoyl-5-(3-fluorophenyl)-3-hydroxy-1-(pyrimidin-2-yl)-1H-pyrrol-2(5H)-one, (4E)-5-(3-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(pyrimidin-2-yl)pyrrolidine-2,3-dione, (4E)-5-(3-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-pyrimidin-2-ylpyrrolidine-2,3-dione
| Molecular Formula | C21H14FN3O3 |
|---|---|
| Molecular Weight | 375.10 g/mol |
| LogP | 3.242 |
| Topological Polar Surface Area | 83.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.10193 |
| Heavy Atoms | 28 |
| Complexity | 1084.3196 |
Chemical Identifiers
| CAS Number | 332170-06-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC=CC=N3)C4=CC(=CC=C4)F)/O |
Product Overview
BAS 01247816 (CAS 332170-06-6), with molecular formula C21H14FN3O3 and molecular weight 375.10 g/mol. IUPAC: (4E)-5-(3-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-pyrimidin-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 01247816
Property Insights of BAS 01247816
The XLogP value of 3.242 indicates that BAS 01247816 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 01247816. Following Lipinski's Rule of Five, BAS 01247816 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 01247816?
The CAS number of BAS 01247816 is 332170-06-6.
What is the molecular formula of BAS 01247816?
The molecular formula of BAS 01247816 is C21H14FN3O3.
What is the molecular weight of BAS 01247816?
The molecular weight of BAS 01247816 is 375.10 g/mol.
Where can I buy BAS 01247816?
You can request a quote for BAS 01247816 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01247816?
Yes, KEHONG BIO provides custom synthesis services for BAS 01247816 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.