N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M447-0326 |
| Compound Name: | N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 471.85 |
| Molecular Formula: | C17 H13 Cl F3 N7 O2 S |
| Smiles: | CN(C)c1nc2c(C3=NN(CC(Nc4ccc(cc4C(F)(F)F)[Cl])=O)C(N3C=N2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3326 |
| logD: | 3.3311 |
| logSw: | -3.7555 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.34 |
| InChI Key: | HHGHFIWLTXXWGP-UHFFFAOYSA-N |