3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(propan-2-yl)propanamide
Chemical Structure Depiction of
3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(propan-2-yl)propanamide
3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(propan-2-yl)propanamide
Compound characteristics
| Compound ID: | D481-0107 |
| Compound Name: | 3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(propan-2-yl)propanamide |
| Molecular Weight: | 382.46 |
| Molecular Formula: | C20 H26 N6 O2 |
| Smiles: | CC(C)NC(CCC1=C(C)Nc2nc(NCc3ccc(C)cc3)nn2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0854 |
| logD: | 2.0422 |
| logSw: | -2.748 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.338 |
| InChI Key: | NRGNNGGKRDUGSU-UHFFFAOYSA-N |