2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-[4-(propan-2-yl)phenyl]acetamide
2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | M447-0288 |
| Compound Name: | 2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C19 H21 N7 O2 S |
| Smiles: | CC(C)c1ccc(cc1)NC(CN1C(N2C=Nc3c(C2=N1)sc(n3)N(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.366 |
| logD: | 3.3646 |
| logSw: | -3.632 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.038 |
| InChI Key: | SXUUXCXGHHPRAD-UHFFFAOYSA-N |