6-chloro-3-[2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Chemical Structure Depiction of
6-chloro-3-[2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
6-chloro-3-[2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
| Compound ID: | 5549-6062 |
| Compound Name: | 6-chloro-3-[2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one |
| Molecular Weight: | 318.71 |
| Molecular Formula: | C15 H11 Cl N2 O4 |
| Smiles: | Cc1c(C(\C=C2/C(=O)Oc3ccc(cc3N2)[Cl])=O)oc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9072 |
| logD: | 2.9048 |
| logSw: | -3.6985 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.906 |
| InChI Key: | JAEJSDRAQVETJS-UHFFFAOYSA-N |