4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one
TL;DR: 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one (CAS 109957-63-3) is a chemical compound with molecular formula C18H15NO4 and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(3,5-dimethoxyphenyl)methylidene]-2-phenyl-1,3-oxazol-5-one
Also Known As: J3.151.141K, 4-(3,5-Dimethoxybenzylidene)-2-phenyloxazol-5(4H)-one, 4-(3,5-dimethoxybenzylidene)-2-phenyl-1,3-oxazol-5(4h)-one, 4-(3,5-DIMETHOXYBENZYLIDENE)-2-PHENYL-2-OXAZOLIN-5-ONE, 4-[(E)-3,5-Dimethoxybenzylidene]-2-phenyloxazole-5(4H)-one
| Molecular Formula | C18H15NO4 |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 3.0483 |
| Topological Polar Surface Area | 57.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.1001 |
| Heavy Atoms | 23 |
| Complexity | 771.6738 |
Chemical Identifiers
| CAS Number | 109957-63-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)/C=C/2\C(=O)OC(=N2)C3=CC=CC=C3)OC |
Product Overview
4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one (CAS 109957-63-3), with molecular formula C18H15NO4 and molecular weight 309.10 g/mol. IUPAC: (4E)-4-[(3,5-dimethoxyphenyl)methylidene]-2-phenyl-1,3-oxazol-5-one.
Chemical Property Profile of 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one
Property Insights of 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one
The XLogP value of 3.0483 indicates that 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.12 Ų, 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one has 0 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-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one?
The CAS number of 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one is 109957-63-3.
What is the molecular formula of 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one?
The molecular formula of 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one is C18H15NO4.
What is the molecular weight of 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one?
The molecular weight of 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one is 309.10 g/mol.
Where can I buy 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one?
You can request a quote for 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,5-Dimethoxybenzylidene)-2-phenyl-2-oxazolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.