ethyl 5-{[2-(1,3-benzoxazol-2-yl)-3-oxoprop-1-en-1-yl]amino}-2-chlorobenzoate
Chemical Structure Depiction of
ethyl 5-{[2-(1,3-benzoxazol-2-yl)-3-oxoprop-1-en-1-yl]amino}-2-chlorobenzoate
ethyl 5-{[2-(1,3-benzoxazol-2-yl)-3-oxoprop-1-en-1-yl]amino}-2-chlorobenzoate
Compound characteristics
| Compound ID: | Y508-1329 |
| Compound Name: | ethyl 5-{[2-(1,3-benzoxazol-2-yl)-3-oxoprop-1-en-1-yl]amino}-2-chlorobenzoate |
| Molecular Weight: | 370.79 |
| Molecular Formula: | C19 H15 Cl N2 O4 |
| Smiles: | CCOC(c1cc(ccc1[Cl])N/C=C(\C=O)c1nc2ccccc2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7267 |
| logD: | 4.7261 |
| logSw: | -4.8737 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.563 |
| InChI Key: | JQSZVKBFNWTYLP-UHFFFAOYSA-N |