1-{3-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]propanoyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{3-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]propanoyl}piperidine-4-carboxamide
1-{3-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]propanoyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F084-0330 |
| Compound Name: | 1-{3-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]propanoyl}piperidine-4-carboxamide |
| Molecular Weight: | 430.53 |
| Molecular Formula: | C20 H26 N6 O3 S |
| Smiles: | CC(C)CN1C(c2c(ccs2)n2c(CCC(N3CCC(CC3)C(N)=O)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7238 |
| logD: | 0.7238 |
| logSw: | -1.8287 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.448 |
| InChI Key: | XHXICMYWLUJAGR-UHFFFAOYSA-N |