4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one
TL;DR: 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one (CAS 496798-83-5) is a chemical compound with molecular formula C27H33NO7 and molecular weight 483.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-5-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Also Known As: 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one, (4E)-4-[(4-butoxy-3-methylphenyl)(hydroxy)methylidene]-5-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione, (4E)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-5-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione, 4-[(4-butoxy-3-methylphenyl)carbonyl]-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C27H33NO7 |
|---|---|
| Molecular Weight | 483.23 g/mol |
| LogP | 4.25922 |
| Topological Polar Surface Area | 94.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 483.2257 |
| Heavy Atoms | 35 |
| Complexity | 1108.7037 |
Chemical Identifiers
| CAS Number | 496798-83-5 |
|---|---|
| SMILES | CCCCOC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCOC)C3=CC(=C(C=C3)OC)OC)/O)C |
Product Overview
4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one (CAS 496798-83-5), with molecular formula C27H33NO7 and molecular weight 483.23 g/mol. IUPAC: (4E)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-5-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one
Property Insights of 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one
The XLogP value of 4.25922 indicates that 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one. Following Lipinski's Rule of Five, 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-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 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one?
The CAS number of 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one is 496798-83-5.
What is the molecular formula of 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one?
The molecular formula of 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one is C27H33NO7.
What is the molecular weight of 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one?
The molecular weight of 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one is 483.23 g/mol.
Where can I buy 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one?
You can request a quote for 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-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-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-butoxy-3-methylbenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-1h-pyrrol-2(5h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.