N-{3-[ethyl(phenyl)amino]propyl}-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-{3-[ethyl(phenyl)amino]propyl}-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
N-{3-[ethyl(phenyl)amino]propyl}-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: | C200-2881 |
| Compound Name: | N-{3-[ethyl(phenyl)amino]propyl}-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: | 494.66 |
| Molecular Formula: | C26 H34 N6 O2 S |
| Smiles: | CCN(CCCNC(CCCc1nnc2N(CC(C)C)C(c3c(ccs3)n12)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.467 |
| logD: | 3.4378 |
| logSw: | -3.8425 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.299 |
| InChI Key: | XEQGMJUEBNVIKF-UHFFFAOYSA-N |