3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one
TL;DR: 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one (CAS 618366-29-3) is a chemical compound with molecular formula C25H25N3O6 and molecular weight 463.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzofuran-2-carbonyl)-1-[2-(diethylamino)ethyl]-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one
Also Known As: 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one, 4-(benzo[d]furan-2-ylcarbonyl)-1-[2-(diethylamino)ethyl]-3-hydroxy-5-(4-nitrop henyl)-3-pyrrolin-2-one, 4-(benzofuran-2-carbonyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(4-nitrophenyl)-1H-pyrrol-2(5H)-one, 4-(benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-3-hydroxy-5-(4-nitrophenyl)-5H-pyrrol-2-one
| Molecular Formula | C25H25N3O6 |
|---|---|
| Molecular Weight | 463.17 g/mol |
| LogP | 4.2611 |
| Topological Polar Surface Area | 117.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 463.17435 |
| Heavy Atoms | 34 |
| Complexity | 1240.3029 |
Chemical Identifiers
| CAS Number | 618366-29-3 |
|---|---|
| SMILES | CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)C2=CC3=CC=CC=C3O2)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one (CAS 618366-29-3), with molecular formula C25H25N3O6 and molecular weight 463.17 g/mol. IUPAC: 3-(1-benzofuran-2-carbonyl)-1-[2-(diethylamino)ethyl]-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one.
Chemical Property Profile of 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one
Property Insights of 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one
The XLogP value of 4.2611 indicates that 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one. Following Lipinski's Rule of Five, 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one 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 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one?
The CAS number of 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one is 618366-29-3.
What is the molecular formula of 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one?
The molecular formula of 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one is C25H25N3O6.
What is the molecular weight of 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one?
The molecular weight of 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one is 463.17 g/mol.
Where can I buy 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one?
You can request a quote for 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-benzofuran-2-carbonyl)-1-(2-diethylaminoethyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.