8-ethyl 2-methyl 4-(piperidin-1-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2,8-dicarboxylate
Chemical Structure Depiction of
8-ethyl 2-methyl 4-(piperidin-1-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2,8-dicarboxylate
8-ethyl 2-methyl 4-(piperidin-1-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2,8-dicarboxylate
Compound characteristics
| Compound ID: | 8016-0805 |
| Compound Name: | 8-ethyl 2-methyl 4-(piperidin-1-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2,8-dicarboxylate |
| Molecular Weight: | 470.47 |
| Molecular Formula: | C20 H21 F3 N4 O4 S |
| Smiles: | CCOC(c1ccc2c(c1)SC1=NC(C(=O)OC)(C(F)(F)F)N=C(N3CCCCC3)N12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3473 |
| logD: | 3.4475 |
| logSw: | -4.2964 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.608 |
| InChI Key: | DXBLWKBNLFOFFX-IBGZPJMESA-N |