4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
TL;DR: 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one (CAS 425619-31-4) is a chemical compound with molecular formula C17H19NO5 and molecular weight 317.13 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-prop-2-enyl-2H-pyrrol-5-one
Also Known As: 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one, AQ-149/42189297, 3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-1-prop-2-enyl-2H-pyrrol-5-one, 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1H-pyrrol-2(5H)-one, (4Z)-5-(3,4-dimethoxyphenyl)-4-(1-hydroxyethylidene)-1-(prop-2-en-1-yl)pyrrolidine-2,3-dione
| Molecular Formula | C17H19NO5 |
|---|---|
| Molecular Weight | 317.13 g/mol |
| LogP | 2.1742 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 317.1263 |
| Heavy Atoms | 23 |
| Complexity | 692.2242 |
Chemical Identifiers
| CAS Number | 425619-31-4 |
|---|---|
| SMILES | CC(=O)C1=C(C(=O)N(C1C2=CC(=C(C=C2)OC)OC)CC=C)O |
Product Overview
4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one (CAS 425619-31-4), with molecular formula C17H19NO5 and molecular weight 317.13 g/mol. IUPAC: 3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-1-prop-2-enyl-2H-pyrrol-5-one.
Chemical Property Profile of 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Property Insights of 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
The XLogP value of 2.1742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one. Following Lipinski's Rule of Five, 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-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-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one?
The CAS number of 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one is 425619-31-4.
What is the molecular formula of 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one?
The molecular formula of 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one is C17H19NO5.
What is the molecular weight of 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one?
The molecular weight of 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one is 317.13 g/mol.
Where can I buy 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one?
You can request a quote for 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-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-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-acetyl-1-allyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.