4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]-N-phenylbutanamide
Chemical Structure Depiction of
4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]-N-phenylbutanamide
4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]-N-phenylbutanamide
Compound characteristics
| Compound ID: | E596-0802 |
| Compound Name: | 4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]-N-phenylbutanamide |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C21 H23 N5 O2 S |
| Smiles: | CC(C)CN1C(c2c(ccs2)n2c(CCCC(Nc3ccccc3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0276 |
| logD: | 3.0276 |
| logSw: | -3.6461 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.146 |
| InChI Key: | FKZYURMGAUEVHR-UHFFFAOYSA-N |