2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F815-0406 |
| Compound Name: | 2-(3-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 447.44 |
| Molecular Formula: | C20 H16 F3 N5 O2 S |
| Smiles: | C1CCc2c(C1)c1C3=NN(CC(Nc4cccc(c4)C(F)(F)F)=O)C(N3C=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2619 |
| logD: | 4.2618 |
| logSw: | -4.5669 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.66 |
| InChI Key: | LXNSLIGHQVRSLN-UHFFFAOYSA-N |