IFLab1_006176
TL;DR: IFLab1_006176 (CAS 618878-06-1) is a chemical compound with molecular formula C20H20FN3O3 and molecular weight 369.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(dimethylamino)ethyl]-4-[(4-fluorophenyl)-hydroxymethylidene]-5-pyridin-2-ylpyrrolidine-2,3-dione
Also Known As: IFLab1_006176, F1525-2173, 1-[2-(dimethylamino)ethyl]-4-(p-fluorobenzoyl)-3-hydroxy-5-(2-pyridyl)-3-pyrrolin-2-one, 1-(2-dimethylaminoethyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-pyridin-2-ylpyrrolidine-2,3-dione, 1-[2-(dimethylamino)ethyl]-4-(4-fluorobenzoyl)-3-hydroxy-5-(pyridin-2-yl)-2,5-dihydro-1H-pyrrol-2-one
| Molecular Formula | C20H20FN3O3 |
|---|---|
| Molecular Weight | 369.15 g/mol |
| LogP | 2.204 |
| Topological Polar Surface Area | 73.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.14886 |
| Heavy Atoms | 27 |
| Complexity | 879.10474 |
Chemical Identifiers
| CAS Number | 618878-06-1 |
|---|---|
| SMILES | CN(C)CCN1C(C(=C(C2=CC=C(C=C2)F)O)C(=O)C1=O)C3=CC=CC=N3 |
Product Overview
IFLab1_006176 (CAS 618878-06-1), with molecular formula C20H20FN3O3 and molecular weight 369.15 g/mol. IUPAC: 1-[2-(dimethylamino)ethyl]-4-[(4-fluorophenyl)-hydroxymethylidene]-5-pyridin-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of IFLab1_006176
Property Insights of IFLab1_006176
The XLogP value of 2.204 suggests moderate lipophilicity, balancing water solubility and membrane permeability for IFLab1_006176. The TPSA of 73.74 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_006176. Following Lipinski's Rule of Five, IFLab1_006176 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 IFLab1_006176?
The CAS number of IFLab1_006176 is 618878-06-1.
What is the molecular formula of IFLab1_006176?
The molecular formula of IFLab1_006176 is C20H20FN3O3.
What is the molecular weight of IFLab1_006176?
The molecular weight of IFLab1_006176 is 369.15 g/mol.
Where can I buy IFLab1_006176?
You can request a quote for IFLab1_006176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_006176?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_006176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.