4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one
TL;DR: 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one (CAS 423725-68-2) is a chemical compound with molecular formula C25H29NO5 and molecular weight 423.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(3,4-dimethoxyphenyl)-1-hexyl-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Also Known As: 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one, (4E)-5-(3,4-dimethoxyphenyl)-1-hexyl-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione, 4-BENZOYL-5-(3,4-DIMETHOXYPHENYL)-1-HEXYL-3-HYDROXY-2,5-DIHYDRO-1H-PYRROL-2-ONE, 5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C25H29NO5 |
|---|---|
| Molecular Weight | 423.20 g/mol |
| LogP | 4.7058 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 423.20456 |
| Heavy Atoms | 31 |
| Complexity | 967.13257 |
Chemical Identifiers
| CAS Number | 423725-68-2 |
|---|---|
| SMILES | CCCCCCN1C(/C(=C(/C2=CC=CC=C2)\O)/C(=O)C1=O)C3=CC(=C(C=C3)OC)OC |
Product Overview
4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one (CAS 423725-68-2), with molecular formula C25H29NO5 and molecular weight 423.20 g/mol. IUPAC: (4E)-5-(3,4-dimethoxyphenyl)-1-hexyl-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one
Property Insights of 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one
The XLogP value of 4.7058 indicates that 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-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-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one. Following Lipinski's Rule of Five, 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-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-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one?
The CAS number of 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one is 423725-68-2.
What is the molecular formula of 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one?
The molecular formula of 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one is C25H29NO5.
What is the molecular weight of 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one?
The molecular weight of 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one is 423.20 g/mol.
Where can I buy 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one?
You can request a quote for 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-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-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-benzoyl-5-(3,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.