N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Chemical Structure Depiction of
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Compound characteristics
| Compound ID: | K788-6185 |
| Compound Name: | N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide |
| Molecular Weight: | 623.22 |
| Molecular Formula: | C36 H35 Cl N4 O2 S |
| Smiles: | Cc1ccc(CN2C(/C(=C\c3ccc(cc3)C(NCCN3CCN(CC3)c3cccc(c3)[Cl])=O)Sc3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.9516 |
| logD: | 6.9275 |
| logSw: | -6.1949 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.567 |
| InChI Key: | XXQDVNVTCQAEIY-UHFFFAOYSA-N |