N-[2-(4-ethoxyphenyl)ethyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
Chemical Structure Depiction of
N-[2-(4-ethoxyphenyl)ethyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
N-[2-(4-ethoxyphenyl)ethyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
Compound characteristics
| Compound ID: | E596-0870 |
| Compound Name: | N-[2-(4-ethoxyphenyl)ethyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide |
| Molecular Weight: | 481.62 |
| Molecular Formula: | C25 H31 N5 O3 S |
| Smiles: | CCOc1ccc(CCNC(CCCc2nnc3N(CC(C)C)C(c4c(ccs4)n23)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0633 |
| logD: | 3.0633 |
| logSw: | -3.5109 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.433 |
| InChI Key: | NXUVEVOXNSASCF-UHFFFAOYSA-N |