2-Phenyl-4-phthalidylidene-5-oxazolone
TL;DR: 2-Phenyl-4-phthalidylidene-5-oxazolone (CAS 35496-44-7) is a chemical compound with molecular formula C17H9NO4 and molecular weight 291.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-oxo-2-benzofuran-1-ylidene)-2-phenyl-1,3-oxazol-5-one
Also Known As: TimTec1_004125, 2-phenyl-4-phthalidylidene-5-oxazolone, 4-(3-oxo-2-benzofuran-1-ylidene)-2-phenyl-1,3-oxazol-5-one, 4-(3-Oxo-3H-isobenzofuran-1-ylidene)-2-phenyl-4H-oxazol-5-one
| Molecular Formula | C17H9NO4 |
|---|---|
| Molecular Weight | 291.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 291.05316 |
| Heavy Atoms | 22 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 35496-44-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=C3C4=CC=CC=C4C(=O)O3)C(=O)O2 |
| InChIKey | ZBQFPLKGISECLP-UHFFFAOYSA-N |
Product Overview
2-Phenyl-4-phthalidylidene-5-oxazolone (CAS 35496-44-7), with molecular formula C17H9NO4 and molecular weight 291.05 g/mol. IUPAC: 4-(3-oxo-2-benzofuran-1-ylidene)-2-phenyl-1,3-oxazol-5-one.
Chemical Property Profile of 2-Phenyl-4-phthalidylidene-5-oxazolone
Property Insights of 2-Phenyl-4-phthalidylidene-5-oxazolone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenyl-4-phthalidylidene-5-oxazolone. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Phenyl-4-phthalidylidene-5-oxazolone. Following Lipinski's Rule of Five, 2-Phenyl-4-phthalidylidene-5-oxazolone 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 2-Phenyl-4-phthalidylidene-5-oxazolone?
The CAS number of 2-Phenyl-4-phthalidylidene-5-oxazolone is 35496-44-7.
What is the molecular formula of 2-Phenyl-4-phthalidylidene-5-oxazolone?
The molecular formula of 2-Phenyl-4-phthalidylidene-5-oxazolone is C17H9NO4.
What is the molecular weight of 2-Phenyl-4-phthalidylidene-5-oxazolone?
The molecular weight of 2-Phenyl-4-phthalidylidene-5-oxazolone is 291.05 g/mol.
Where can I buy 2-Phenyl-4-phthalidylidene-5-oxazolone?
You can request a quote for 2-Phenyl-4-phthalidylidene-5-oxazolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenyl-4-phthalidylidene-5-oxazolone?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenyl-4-phthalidylidene-5-oxazolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.