4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one
TL;DR: 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one (CAS 618378-86-2) is a chemical compound with molecular formula C30H29NO6 and molecular weight 499.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-1-(oxolan-2-ylmethyl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione
Also Known As: 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one, (4E)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-1-(oxolan-2-ylmethyl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione
| Molecular Formula | C30H29NO6 |
|---|---|
| Molecular Weight | 499.20 g/mol |
| LogP | 5.4783 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 499.1995 |
| Heavy Atoms | 37 |
| Complexity | 1295.1616 |
Chemical Identifiers
| CAS Number | 618378-86-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CC3CCCO3)C4=CC(=CC=C4)OC5=CC=CC=C5)/O |
Product Overview
4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one (CAS 618378-86-2), with molecular formula C30H29NO6 and molecular weight 499.20 g/mol. IUPAC: (4E)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-1-(oxolan-2-ylmethyl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one
Property Insights of 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one
The XLogP value of 5.4783 indicates that 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one. Following Lipinski's Rule of Five, 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one?
The CAS number of 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one is 618378-86-2.
What is the molecular formula of 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one?
The molecular formula of 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one is C30H29NO6.
What is the molecular weight of 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one?
The molecular weight of 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one is 499.20 g/mol.
Where can I buy 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one?
You can request a quote for 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-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-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-ethoxybenzoyl)-3-hydroxy-1-[(oxolan-2-yl)methyl]-5-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.