3-[2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-oxoethylidene]-6-(ethanesulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-2-one
Chemical Structure Depiction of
3-[2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-oxoethylidene]-6-(ethanesulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-2-one
3-[2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-oxoethylidene]-6-(ethanesulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
| Compound ID: | 5549-6014 |
| Compound Name: | 3-[2-(2,4-dimethyl-1,3-oxazol-5-yl)-2-oxoethylidene]-6-(ethanesulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-2-one |
| Molecular Weight: | 376.39 |
| Molecular Formula: | C17 H16 N2 O6 S |
| Smiles: | CCS(c1ccc2c(c1)NC(=C\C(c1c(C)nc(C)o1)=O)\C(=O)O2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5012 |
| logD: | 1.5002 |
| logSw: | -2.5519 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.942 |
| InChI Key: | DYZXGRYHTLMNPT-UHFFFAOYSA-N |