N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
Compound characteristics
| Compound ID: | F084-0055 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide |
| Molecular Weight: | 452.58 |
| Molecular Formula: | C23 H28 N6 O2 S |
| Smiles: | CCN(CCCNC(CCc1nnc2N(C)C(c3c(ccs3)n12)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.2622 |
| logD: | 2.2299 |
| logSw: | -2.8639 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.065 |
| InChI Key: | IVENNIHISTVXMY-UHFFFAOYSA-N |