4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]-N-[(pyridin-3-yl)methyl]benzamide
Chemical Structure Depiction of
4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]-N-[(pyridin-3-yl)methyl]benzamide
4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]-N-[(pyridin-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | K788-3760 |
| Compound Name: | 4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]-N-[(pyridin-3-yl)methyl]benzamide |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C22 H17 N3 O2 S |
| Smiles: | C(c1cccnc1)NC(c1ccc(\C=C2/C(Nc3ccccc3S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8169 |
| logD: | 2.8168 |
| logSw: | -3.2363 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.776 |
| InChI Key: | JJBIKHFEJJQRFW-UHFFFAOYSA-N |