3-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-{3-[ethyl(phenyl)amino]propyl}propanamide
Chemical Structure Depiction of
3-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-{3-[ethyl(phenyl)amino]propyl}propanamide
3-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-{3-[ethyl(phenyl)amino]propyl}propanamide
Compound characteristics
| Compound ID: | C200-4166 |
| Compound Name: | 3-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-{3-[ethyl(phenyl)amino]propyl}propanamide |
| Molecular Weight: | 452.58 |
| Molecular Formula: | C23 H28 N6 O2 S |
| Smiles: | CCN(CCCNC(CCc1nnc2N(CC)C(c3c(ccs3)n12)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3574 |
| logD: | 2.3283 |
| logSw: | -2.741 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.024 |
| InChI Key: | RRAVRJZGNGTHAV-UHFFFAOYSA-N |