4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one
TL;DR: 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one (CAS 103841-97-0) is a chemical compound with molecular formula C16H9Cl2NO2 and molecular weight 317.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(3,4-dichlorophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one
Also Known As: 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one, 4-(3,4-dichlorobenzylidene)-2-phenyl-1,3-oxazol-5(4h)-one, A1035/0048518, (4E)-4-(3,4-dichlorobenzylidene)-2-phenyl-1,3-oxazol-5(4H)-one, (4E)-4-[(3,4-dichlorophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one
| Molecular Formula | C16H9Cl2NO2 |
|---|---|
| Molecular Weight | 317.00 g/mol |
| LogP | 4.3379 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.00104 |
| Heavy Atoms | 21 |
| Complexity | 767.1014 |
Chemical Identifiers
| CAS Number | 103841-97-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=N/C(=C/C3=CC(=C(C=C3)Cl)Cl)/C(=O)O2 |
Product Overview
4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one (CAS 103841-97-0), with molecular formula C16H9Cl2NO2 and molecular weight 317.00 g/mol. IUPAC: (4E)-4-[(3,4-dichlorophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one.
Chemical Property Profile of 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one
Property Insights of 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one
The XLogP value of 4.3379 indicates that 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one has 0 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 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one?
The CAS number of 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one is 103841-97-0.
What is the molecular formula of 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one?
The molecular formula of 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one is C16H9Cl2NO2.
What is the molecular weight of 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one?
The molecular weight of 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one is 317.00 g/mol.
Where can I buy 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one?
You can request a quote for 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,4-Dichlorobenzylidene)-2-phenyloxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.