N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-4-methyl-2-[(3-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-4-methyl-2-[(3-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-4-methyl-2-[(3-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K788-9571 |
| Compound Name: | N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-4-methyl-2-[(3-methylphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 561.15 |
| Molecular Formula: | C31 H33 Cl N4 O2 S |
| Smiles: | Cc1cccc(\C=C2/C(N(C)c3cc(ccc3S2)C(NCCN2CCN(CC2)c2cc(ccc2C)[Cl])=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.9191 |
| logD: | 5.806 |
| logSw: | -6.1104 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.304 |
| InChI Key: | JKJBTVIELSKFKO-UHFFFAOYSA-N |