![4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one structure](/static/products/6694/66949-11-9.webp)
4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one
TL;DR: 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one (CAS 66949-11-9) is a chemical compound with molecular formula C16H10N2O4 and molecular weight 294.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one
Also Known As: NCIOpen2_004796, 4-[(3-nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one, 5(4H)-Oxazolone,4-[(3-nitrophenyl)methylene]-2-phenyl-, 5(4H)-Oxazolone, 4-[(3-nitrophenyl)methylene]-2-phenyl-, (Z)-
| Molecular Formula | C16H10N2O4 |
|---|---|
| Molecular Weight | 294.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.06406 |
| Heavy Atoms | 22 |
| Complexity | 515.0 |
Chemical Identifiers
| CAS Number | 66949-11-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)O2 |
| InChIKey | DLKLBYNRYHZMMX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one (CAS 66949-11-9), with molecular formula C16H10N2O4 and molecular weight 294.06 g/mol. IUPAC: 4-[(3-nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one.
Chemical Property Profile of 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one
Property Insights of 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one
The XLogP value of 3.4 indicates that 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one. Following Lipinski's Rule of Five, 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-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-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one?
The CAS number of 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one is 66949-11-9.
What is the molecular formula of 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one?
The molecular formula of 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one is C16H10N2O4.
What is the molecular weight of 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one?
The molecular weight of 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one is 294.06 g/mol.
Where can I buy 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one?
You can request a quote for 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-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-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-Nitrophenyl)methylidene]-2-phenyl-1,3-oxazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.