N-[3-(4-benzylpiperazin-1-yl)propyl]-4-({4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-4-({4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-4-({4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Compound characteristics
| Compound ID: | K788-9403 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-4-({4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide |
| Molecular Weight: | 616.83 |
| Molecular Formula: | C38 H40 N4 O2 S |
| Smiles: | Cc1ccccc1CN1C(/C(=C\c2ccc(cc2)C(NCCCN2CCN(CC2)Cc2ccccc2)=O)Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3675 |
| logD: | 5.5966 |
| logSw: | -5.4624 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.847 |
| InChI Key: | OGYAOWRGUYNXCT-UHFFFAOYSA-N |