4-[(2-chloroanilino)methylidene]-2-(3-methoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2-chloroanilino)methylidene]-2-(3-methoxyphenyl)-1,3-oxazol-5(4H)-one
4-[(2-chloroanilino)methylidene]-2-(3-methoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0472 |
| Compound Name: | 4-[(2-chloroanilino)methylidene]-2-(3-methoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 328.75 |
| Molecular Formula: | C17 H13 Cl N2 O3 |
| Smiles: | COc1cccc(c1)C1=NC(=C/Nc2ccccc2[Cl])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.4148 |
| logD: | 3.4132 |
| logSw: | -4.0041 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.822 |
| InChI Key: | XPJFCBNGECJSCD-UHFFFAOYSA-N |