6-chloro-3-[2-(2,4-dimethyl-1,3-thiazol-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-thiazol-5-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
6-chloro-3-[2-(2,4-dimethyl-1,3-thiazol-5-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
| Compound ID: | 5549-6073 |
| Compound Name: | 6-chloro-3-[2-(2,4-dimethyl-1,3-thiazol-5-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one |
| Molecular Weight: | 334.78 |
| Molecular Formula: | C15 H11 Cl N2 O3 S |
| Smiles: | Cc1c(C(\C=C2/C(=O)Oc3ccc(cc3N2)[Cl])=O)sc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5576 |
| logD: | 3.5542 |
| logSw: | -4.2223 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.784 |
| InChI Key: | LKYXBXMDGCVOPC-UHFFFAOYSA-N |