![4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one structure](/static/products/868/86818-83-9.png)
4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one
TL;DR: 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one (CAS 86818-83-9) is a chemical compound with molecular formula C18H14N2O6 and molecular weight 354.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,4-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one
Also Known As: 4-[(3,4-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one, 4-(3,4-Dimethoxy-benzylidene)-2-(4-nitro-phenyl)-4H-oxazol-5-one, 4-[(3,4-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-o
| Molecular Formula | C18H14N2O6 |
|---|---|
| Molecular Weight | 354.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.08517 |
| Heavy Atoms | 26 |
| Complexity | 603.0 |
Chemical Identifiers
| CAS Number | 86818-83-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])OC |
| InChIKey | ZRFWFMCSJCCNQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one (CAS 86818-83-9), with molecular formula C18H14N2O6 and molecular weight 354.09 g/mol. IUPAC: 4-[(3,4-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one.
Chemical Property Profile of 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one
Property Insights of 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one
The XLogP value of 3.3 indicates that 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one. Following Lipinski's Rule of Five, 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one has 0 hydrogen bond donor(s) and 7 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-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one?
The CAS number of 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one is 86818-83-9.
What is the molecular formula of 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one?
The molecular formula of 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one is C18H14N2O6.
What is the molecular weight of 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one?
The molecular weight of 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one is 354.09 g/mol.
Where can I buy 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one?
You can request a quote for 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-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-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,4-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-1,3-oxazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.