![(4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one structure](/static/products/809/80947-47-3.png)
(4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one
TL;DR: (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one (CAS 80947-47-3) is a chemical compound with molecular formula C21H14N2O2S and molecular weight 358.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-4-[(1-phenyl-2-sulfanylidene-3-pyridinyl)methylidene]-1,3-oxazol-5-one
Also Known As: (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one, 2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one
| Molecular Formula | C21H14N2O2S |
|---|---|
| Molecular Weight | 358.08 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 74.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.0776 |
| Heavy Atoms | 26 |
| Complexity | 708.0 |
Chemical Identifiers
| CAS Number | 80947-47-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CC3=CC=CN(C3=S)C4=CC=CC=C4)C(=O)O2 |
| InChIKey | GVASNDIHKCIYBY-UHFFFAOYSA-N |
Product Overview
(4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one (CAS 80947-47-3), with molecular formula C21H14N2O2S and molecular weight 358.08 g/mol. IUPAC: 2-phenyl-4-[(1-phenyl-2-sulfanylidene-3-pyridinyl)methylidene]-1,3-oxazol-5-one.
Chemical Property Profile of (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one
Property Insights of (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one
The XLogP value of 4.2 indicates that (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one. Following Lipinski's Rule of Five, (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one has 0 hydrogen bond donor(s) and 4 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 (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one?
The CAS number of (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one is 80947-47-3.
What is the molecular formula of (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one?
The molecular formula of (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one is C21H14N2O2S.
What is the molecular weight of (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one?
The molecular weight of (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one is 358.08 g/mol.
Where can I buy (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one?
You can request a quote for (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-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 (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for (4E)-2-phenyl-4-[(1-phenyl-2-sulfanylidenepyridin-3-yl)methylidene]-1,3-oxazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.