RefChem:513196
TL;DR: RefChem:513196 (CAS 618075-15-3) is a chemical compound with molecular formula C21H19FN2O7 and molecular weight 430.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(3-fluoro-4-methoxyphenyl)-hydroxymethylidene]-1-(2-methoxyethyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: SALOR-INT L429171-1EA, 4-(3-FLUORO-4-METHOXYBENZOYL)-3-HYDROXY-1-(2-METHOXYETHYL)-5-(3-NITROPHENYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 4-(3-Fluoro-4-methoxybenzoyl)-3-hydroxy-1-(2-methoxyethyl)-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one, 645-763-6, RefChem:513196
| Molecular Formula | C21H19FN2O7 |
|---|---|
| Molecular Weight | 430.12 g/mol |
| LogP | 2.8106 |
| Topological Polar Surface Area | 119.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.1176 |
| Heavy Atoms | 31 |
| Complexity | 1083.148 |
Chemical Identifiers
| CAS Number | 618075-15-3 |
|---|---|
| SMILES | COCCN1C(/C(=C(/C2=CC(=C(C=C2)OC)F)\O)/C(=O)C1=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
RefChem:513196 (CAS 618075-15-3), with molecular formula C21H19FN2O7 and molecular weight 430.12 g/mol. IUPAC: (4E)-4-[(3-fluoro-4-methoxyphenyl)-hydroxymethylidene]-1-(2-methoxyethyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of RefChem:513196
Property Insights of RefChem:513196
The XLogP value of 2.8106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:513196. The TPSA of 119.21 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:513196. Following Lipinski's Rule of Five, RefChem:513196 has 1 hydrogen bond donor(s) and 7 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 RefChem:513196?
The CAS number of RefChem:513196 is 618075-15-3.
What is the molecular formula of RefChem:513196?
The molecular formula of RefChem:513196 is C21H19FN2O7.
What is the molecular weight of RefChem:513196?
The molecular weight of RefChem:513196 is 430.12 g/mol.
Where can I buy RefChem:513196?
You can request a quote for RefChem:513196 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:513196?
Yes, KEHONG BIO provides custom synthesis services for RefChem:513196 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.