N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Compound characteristics
| Compound ID: | K788-3314 |
| Compound Name: | N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide |
| Molecular Weight: | 533.09 |
| Molecular Formula: | C29 H29 Cl N4 O2 S |
| Smiles: | C(CNC(c1ccc(\C=C2/C(Nc3ccccc3S2)=O)cc1)=O)CN1CCN(CC1)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5543 |
| logD: | 4.0104 |
| logSw: | -4.7579 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.342 |
| InChI Key: | IFOMGFNIXQFTLM-UHFFFAOYSA-N |