ethyl 4-{2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperazine-1-carboxylate
ethyl 4-{2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C700-0552 |
| Compound Name: | ethyl 4-{2-[(4-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C24 H25 N3 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(c1ccc2c(c1)NC(/C(=C\c1ccc(C)cc1)S2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8689 |
| logD: | 3.8689 |
| logSw: | -3.8522 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.273 |
| InChI Key: | GTZDYFINKHCZKR-UHFFFAOYSA-N |