N-{3-[ethyl(phenyl)amino]propyl}-4-(4-methyl-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-methyl-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-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide
Compound characteristics
| Compound ID: | C200-2777 |
| Compound Name: | N-{3-[ethyl(phenyl)amino]propyl}-4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide |
| Molecular Weight: | 452.58 |
| Molecular Formula: | C23 H28 N6 O2 S |
| Smiles: | CCN(CCCNC(CCCc1nnc2N(C)C(c3c(ccs3)n12)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9878 |
| logD: | 1.9587 |
| logSw: | -2.5063 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.065 |
| InChI Key: | UKOBGDXORPCLPI-UHFFFAOYSA-N |