(E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate
TL;DR: (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate (CAS 5659-57-4) is a chemical compound with molecular formula C19H16N2O4 and molecular weight 336.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(5-hydroxy-2-phenyl-1,3-oxazol-4-yl)methylideneamino]benzoate
Also Known As: BAS 00795926, BIM-0014993.P001, (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate, ethyl 4-[(5-oxo-2-phenyl-1,3-oxazol-4-ylidene)methylamino]benzoate, 4-[(5-Oxo-2-phenyl-oxazol-4-ylidenemethyl)-amino]-benzoic acid ethyl ester
| Molecular Formula | C19H16N2O4 |
|---|---|
| Molecular Weight | 336.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 84.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.111 |
| Heavy Atoms | 25 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 5659-57-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N=CC2=C(OC(=N2)C3=CC=CC=C3)O |
| InChIKey | QTDWVDMGUJAPGL-UHFFFAOYSA-N |
Product Overview
(E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate (CAS 5659-57-4), with molecular formula C19H16N2O4 and molecular weight 336.11 g/mol. IUPAC: ethyl 4-[(5-hydroxy-2-phenyl-1,3-oxazol-4-yl)methylideneamino]benzoate.
Chemical Property Profile of (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate
Property Insights of (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate
The XLogP value of 3.8 indicates that (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate. Following Lipinski's Rule of Five, (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate has 1 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 (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate?
The CAS number of (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate is 5659-57-4.
What is the molecular formula of (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate?
The molecular formula of (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate is C19H16N2O4.
What is the molecular weight of (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate?
The molecular weight of (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate is 336.11 g/mol.
Where can I buy (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate?
You can request a quote for (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 4-(((5-oxo-2-phenyloxazol-4(5H)-ylidene)methyl)amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.