1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one
TL;DR: 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one (CAS 615271-95-9) is a chemical compound with molecular formula C23H24FN3O5 and molecular weight 441.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-[2-(diethylamino)ethyl]-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one, (4E)-1-(2-diethylaminoethyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione, 1-[2-(diethylamino)ethyl]-4-[(4-fluorophenyl)carbonyl]-3-hydroxy-5-(3-nitrophe nyl)-3-pyrrolin-2-one
| Molecular Formula | C23H24FN3O5 |
|---|---|
| Molecular Weight | 441.17 g/mol |
| LogP | 3.4974 |
| Topological Polar Surface Area | 103.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 441.17 |
| Heavy Atoms | 32 |
| Complexity | 1063.5565 |
Chemical Identifiers
| CAS Number | 615271-95-9 |
|---|---|
| SMILES | CCN(CC)CCN1C(/C(=C(/C2=CC=C(C=C2)F)\O)/C(=O)C1=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one (CAS 615271-95-9), with molecular formula C23H24FN3O5 and molecular weight 441.17 g/mol. IUPAC: (4E)-1-[2-(diethylamino)ethyl]-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one
Property Insights of 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one
The XLogP value of 3.4974 indicates that 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one. Following Lipinski's Rule of Five, 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one has 1 hydrogen bond donor(s) and 6 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 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one?
The CAS number of 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one is 615271-95-9.
What is the molecular formula of 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one?
The molecular formula of 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one is C23H24FN3O5.
What is the molecular weight of 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one?
The molecular weight of 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one is 441.17 g/mol.
Where can I buy 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one?
You can request a quote for 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(diethylamino)ethyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.