1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one
TL;DR: 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one (CAS 488794-31-6) is a chemical compound with molecular formula C20H15Cl2NO3 and molecular weight 387.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-chlorophenyl)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-prop-2-enylpyrrolidine-2,3-dione
Also Known As: 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one, (4E)-5-(4-chlorophenyl)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(prop-2-en-1-yl)pyrrolidine-2,3-dione, (4E)-5-(4-chlorophenyl)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-prop-2-enylpyrrolidine-2,3-dione
| Molecular Formula | C20H15Cl2NO3 |
|---|---|
| Molecular Weight | 387.04 g/mol |
| LogP | 4.6011 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.0429 |
| Heavy Atoms | 26 |
| Complexity | 901.65845 |
Chemical Identifiers
| CAS Number | 488794-31-6 |
|---|---|
| SMILES | C=CCN1C(/C(=C(/C2=CC=C(C=C2)Cl)\O)/C(=O)C1=O)C3=CC=C(C=C3)Cl |
Product Overview
1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one (CAS 488794-31-6), with molecular formula C20H15Cl2NO3 and molecular weight 387.04 g/mol. IUPAC: (4E)-5-(4-chlorophenyl)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-prop-2-enylpyrrolidine-2,3-dione.
Chemical Property Profile of 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one
Property Insights of 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one
The XLogP value of 4.6011 indicates that 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-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-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-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-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
The CAS number of 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one is 488794-31-6.
What is the molecular formula of 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
The molecular formula of 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one is C20H15Cl2NO3.
What is the molecular weight of 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
The molecular weight of 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one is 387.04 g/mol.
Where can I buy 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
You can request a quote for 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-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 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-allyl-4-(4-chlorobenzoyl)-5-(4-chlorophenyl)-3-hydroxy-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.