(E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one
TL;DR: (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one (CAS 68099-99-0) is a chemical compound with molecular formula C17H13NO2 and molecular weight 263.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-4-(1-phenylethylidene)-1,3-oxazol-5-one
Also Known As: NCI60_003148, NCI60_003149, (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one, 2-phenyl-4-(1-phenylethylidene)-1,3-oxazol-5-one
| Molecular Formula | C17H13NO2 |
|---|---|
| Molecular Weight | 263.09 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.09464 |
| Heavy Atoms | 20 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 68099-99-0 |
|---|---|
| SMILES | CC(=C1C(=O)OC(=N1)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | TYPJAOYNIKQSCQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one (CAS 68099-99-0), with molecular formula C17H13NO2 and molecular weight 263.09 g/mol. IUPAC: 2-phenyl-4-(1-phenylethylidene)-1,3-oxazol-5-one.
Chemical Property Profile of (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one
Property Insights of (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one
The XLogP value of 4.2 indicates that (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-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 (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one?
The CAS number of (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one is 68099-99-0.
What is the molecular formula of (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one?
The molecular formula of (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one is C17H13NO2.
What is the molecular weight of (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one?
The molecular weight of (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one is 263.09 g/mol.
Where can I buy (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one?
You can request a quote for (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-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 (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-Phenyl-4-(1-phenylethylidene)oxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.