methyl 8-chloro-4-(piperidin-1-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2-carboxylate
Chemical Structure Depiction of
methyl 8-chloro-4-(piperidin-1-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2-carboxylate
methyl 8-chloro-4-(piperidin-1-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2-carboxylate
Compound characteristics
| Compound ID: | 8016-0847 |
| Compound Name: | methyl 8-chloro-4-(piperidin-1-yl)-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2-carboxylate |
| Molecular Weight: | 432.85 |
| Molecular Formula: | C17 H16 Cl F3 N4 O2 S |
| Smiles: | COC(C1(C(F)(F)F)N=C(N2CCCCC2)N2C(=N1)Sc1cc(ccc12)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1653 |
| logD: | 3.2655 |
| logSw: | -4.4448 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.855 |
| InChI Key: | LZGGEGWUPXOOJP-INIZCTEOSA-N |