4-[(Z)-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl]-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]benzamide
Chemical Structure Depiction of
4-[(Z)-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl]-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]benzamide
4-[(Z)-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl]-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | C700-0280 |
| Compound Name: | 4-[(Z)-{4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl]-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]benzamide |
| Molecular Weight: | 567.79 |
| Molecular Formula: | C35 H41 N3 O2 S |
| Smiles: | CC1CCCC(C)N1CCCNC(c1ccc(/C=C2/C(N(Cc3cc(C)ccc3C)c3ccccc3S2)=O)cc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.0986 |
| logD: | 3.9979 |
| logSw: | -5.5352 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.862 |
| InChI Key: | NIHYNGUITOSPAO-UHFFFAOYSA-N |