![4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one structure](/static/products/5993/59935-38-5.webp)
4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
TL;DR: 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one (CAS 59935-38-5) is a chemical compound with molecular formula C18H15N3O4 and molecular weight 337.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
Also Known As: Dmanbpo, 4- benzylidene-2-phenyloxazolin-5-one, 4-[4-(dimethylamino)-3-nitrobenzylidene]-2-phenyl-1,3-oxazol-5(4H)-one, 4-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
| Molecular Formula | C18H15N3O4 |
|---|---|
| Molecular Weight | 337.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.10626 |
| Heavy Atoms | 25 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 59935-38-5 |
|---|---|
| SMILES | CN(C)C1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=CC=CC=C3)[N+](=O)[O-] |
| InChIKey | HMLOUVRIWZZLLM-UHFFFAOYSA-N |
Product Overview
4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one (CAS 59935-38-5), with molecular formula C18H15N3O4 and molecular weight 337.11 g/mol. IUPAC: 4-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one.
Chemical Property Profile of 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
Property Insights of 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
The XLogP value of 3.5 indicates that 4-[[4-(Dimethylamino)-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 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one. Following Lipinski's Rule of Five, 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one has 0 hydrogen bond donor(s) and 6 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-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
The CAS number of 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one is 59935-38-5.
What is the molecular formula of 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
The molecular formula of 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one is C18H15N3O4.
What is the molecular weight of 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
The molecular weight of 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one is 337.11 g/mol.
Where can I buy 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
You can request a quote for 4-[[4-(Dimethylamino)-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-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[[4-(Dimethylamino)-3-nitrophenyl]methylidene]-2-phenyl-1,3-oxazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.