4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one
TL;DR: 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one (CAS 489416-08-2) is a chemical compound with molecular formula C23H25N3O5 and molecular weight 423.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-1-[2-(diethylamino)ethyl]-4-[hydroxy(phenyl)methylidene]-5-(2-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one, (4Z)-1-(2-diethylaminoethyl)-4-[hydroxy(phenyl)methylidene]-5-(2-nitrophenyl)pyrrolidine-2,3-dione
| Molecular Formula | C23H25N3O5 |
|---|---|
| Molecular Weight | 423.18 g/mol |
| LogP | 3.3583 |
| Topological Polar Surface Area | 103.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 423.1794 |
| Heavy Atoms | 31 |
| Complexity | 1014.88184 |
Chemical Identifiers
| CAS Number | 489416-08-2 |
|---|---|
| SMILES | CCN(CC)CCN1C(/C(=C(\C2=CC=CC=C2)/O)/C(=O)C1=O)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one (CAS 489416-08-2), with molecular formula C23H25N3O5 and molecular weight 423.18 g/mol. IUPAC: (4Z)-1-[2-(diethylamino)ethyl]-4-[hydroxy(phenyl)methylidene]-5-(2-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one
Property Insights of 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one
The XLogP value of 3.3583 indicates that 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-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 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one. Following Lipinski's Rule of Five, 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-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 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one?
The CAS number of 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one is 489416-08-2.
What is the molecular formula of 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one?
The molecular formula of 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one is C23H25N3O5.
What is the molecular weight of 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one?
The molecular weight of 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one is 423.18 g/mol.
Where can I buy 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one?
You can request a quote for 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-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 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-benzoyl-1-(2-(diethylamino)ethyl)-3-hydroxy-5-(2-nitrophenyl)-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.