N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-[(E)-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-[(E)-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-[(E)-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Compound characteristics
| Compound ID: | K788-3034 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-[(E)-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide |
| Molecular Weight: | 449.61 |
| Molecular Formula: | C26 H31 N3 O2 S |
| Smiles: | CC1CC(C)CN(CCCNC(c2ccc(\C=C3/C(Nc4ccccc4S3)=O)cc2)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1867 |
| logD: | 1.6397 |
| logSw: | -4.03 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.949 |
| InChI Key: | HJUQIOHAAMIFHH-UHFFFAOYSA-N |