6-(ethanesulfonyl)-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Chemical Structure Depiction of
6-(ethanesulfonyl)-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
6-(ethanesulfonyl)-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
| Compound ID: | 8012-6930 |
| Compound Name: | 6-(ethanesulfonyl)-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one |
| Molecular Weight: | 375.37 |
| Molecular Formula: | C18 H14 F N O5 S |
| Smiles: | CCS(c1ccc2c(c1)NC(=C/C(c1ccc(cc1)F)=O)\C(=O)O2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3761 |
| logD: | 2.3723 |
| logSw: | -2.9604 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.431 |
| InChI Key: | QKICUSRAMZICAI-UHFFFAOYSA-N |