4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one
TL;DR: 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one (CAS 499997-65-8) is a chemical compound with molecular formula C22H23NO5 and molecular weight 381.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-1-(2-phenylethyl)-2H-pyrrol-5-one
Also Known As: BAS 01157273, 3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-1-phenethyl-2H-pyrrol-5-one, 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one, (4Z)-5-(3,4-dimethoxyphenyl)-4-(1-hydroxyethylidene)-1-(2-phenylethyl)pyrrolidine-2,3-dione
| Molecular Formula | C22H23NO5 |
|---|---|
| Molecular Weight | 381.16 g/mol |
| LogP | 3.2309 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.15762 |
| Heavy Atoms | 28 |
| Complexity | 919.7793 |
Chemical Identifiers
| CAS Number | 499997-65-8 |
|---|---|
| SMILES | CC(=O)C1=C(C(=O)N(C1C2=CC(=C(C=C2)OC)OC)CCC3=CC=CC=C3)O |
Product Overview
4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one (CAS 499997-65-8), with molecular formula C22H23NO5 and molecular weight 381.16 g/mol. IUPAC: 3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-1-(2-phenylethyl)-2H-pyrrol-5-one.
Chemical Property Profile of 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one
Property Insights of 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one
The XLogP value of 3.2309 indicates that 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one. Following Lipinski's Rule of Five, 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one 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 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one?
The CAS number of 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one is 499997-65-8.
What is the molecular formula of 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one?
The molecular formula of 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one is C22H23NO5.
What is the molecular weight of 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one?
The molecular weight of 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one is 381.16 g/mol.
Where can I buy 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one?
You can request a quote for 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-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-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-phenethyl-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.