12-(pyridin-4-yl)-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine
Chemical Structure Depiction of
12-(pyridin-4-yl)-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine
12-(pyridin-4-yl)-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine
Compound characteristics
| Compound ID: | K784-1907 |
| Compound Name: | 12-(pyridin-4-yl)-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C20 H13 N3 S2 |
| Smiles: | c1ccc2c(c1)nc1c(c(c3ccncc3)sc3ccccc3[nH]1)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.4172 |
| logD: | 5.4159 |
| logSw: | -5.8138 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.8321 |
| InChI Key: | KEKMTTRGEHVQJD-UHFFFAOYSA-N |