ethyl 4-oxo-2,2-bis(trifluoromethyl)-3,4-dihydro-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-8-carboxylate
Chemical Structure Depiction of
ethyl 4-oxo-2,2-bis(trifluoromethyl)-3,4-dihydro-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-8-carboxylate
ethyl 4-oxo-2,2-bis(trifluoromethyl)-3,4-dihydro-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-8-carboxylate
Compound characteristics
| Compound ID: | 8016-0448 |
| Compound Name: | ethyl 4-oxo-2,2-bis(trifluoromethyl)-3,4-dihydro-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-8-carboxylate |
| Molecular Weight: | 413.3 |
| Molecular Formula: | C14 H9 F6 N3 O3 S |
| Smiles: | CCOC(c1ccc2c(c1)SC1=NC(C(F)(F)F)(C(F)(F)F)NC(N12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1642 |
| logD: | -0.5276 |
| logSw: | -4.2117 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.092 |
| InChI Key: | IDQOBEBVPNMOCY-UHFFFAOYSA-N |