4-oxo-N-[4-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Chemical Structure Depiction of
4-oxo-N-[4-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
4-oxo-N-[4-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | D358-0484 |
| Compound Name: | 4-oxo-N-[4-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide |
| Molecular Weight: | 393.39 |
| Molecular Formula: | C18 H14 F3 N3 O2 S |
| Smiles: | C1CCC2=C(C1)N1C(=NC=C(C(Nc3ccc(cc3)C(F)(F)F)=O)C1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 3.1853 |
| logD: | 3.0278 |
| logSw: | -3.5878 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.715 |
| InChI Key: | YRMDFMLMYLDVRP-UHFFFAOYSA-N |