1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one
TL;DR: 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one (CAS 425424-06-2) is a chemical compound with molecular formula C23H23NO3 and molecular weight 361.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy(phenyl)methylidene]-5-(4-propan-2-ylphenyl)-1-prop-2-enylpyrrolidine-2,3-dione
Also Known As: 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one, 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-4-[hydroxy(phenyl)methylidene]-5-(4-propan-2-ylphenyl)-1-prop-2-enylpyrrolidine-2,3-dione, 3-hydroxy-4-(phenylcarbonyl)-5-[4-(propan-2-yl)phenyl]-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C23H23NO3 |
|---|---|
| Molecular Weight | 361.17 g/mol |
| LogP | 4.4177 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.1678 |
| Heavy Atoms | 27 |
| Complexity | 894.9805 |
Chemical Identifiers
| CAS Number | 425424-06-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2CC=C |
Product Overview
1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one (CAS 425424-06-2), with molecular formula C23H23NO3 and molecular weight 361.17 g/mol. IUPAC: (4E)-4-[hydroxy(phenyl)methylidene]-5-(4-propan-2-ylphenyl)-1-prop-2-enylpyrrolidine-2,3-dione.
Chemical Property Profile of 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one
Property Insights of 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one
The XLogP value of 4.4177 indicates that 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one has 1 hydrogen bond donor(s) and 3 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 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one?
The CAS number of 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one is 425424-06-2.
What is the molecular formula of 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one?
The molecular formula of 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one is C23H23NO3.
What is the molecular weight of 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one?
The molecular weight of 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one is 361.17 g/mol.
Where can I buy 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one?
You can request a quote for 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-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 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.