6-(ethanesulfonyl)-3-[2-(4-methylphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Chemical Structure Depiction of
6-(ethanesulfonyl)-3-[2-(4-methylphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
6-(ethanesulfonyl)-3-[2-(4-methylphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
| Compound ID: | 8012-6092 |
| Compound Name: | 6-(ethanesulfonyl)-3-[2-(4-methylphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one |
| Molecular Weight: | 371.41 |
| Molecular Formula: | C19 H17 N O5 S |
| Smiles: | CCS(c1ccc2c(c1)NC(=C/C(c1ccc(C)cc1)=O)\C(=O)O2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7704 |
| logD: | 2.7666 |
| logSw: | -3.317 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.431 |
| InChI Key: | OLGWUQVVEHVYAE-UHFFFAOYSA-N |