3-[2-(benzylamino)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(pyridin-3-yl)propanamide
Chemical Structure Depiction of
3-[2-(benzylamino)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(pyridin-3-yl)propanamide
3-[2-(benzylamino)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(pyridin-3-yl)propanamide
Compound characteristics
| Compound ID: | D481-0050 |
| Compound Name: | 3-[2-(benzylamino)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(pyridin-3-yl)propanamide |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C21 H21 N7 O2 |
| Smiles: | CC1=C(CCC(Nc2cccnc2)=O)C(n2c(N1)nc(NCc1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6773 |
| logD: | 1.6338 |
| logSw: | -1.3175 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.287 |
| InChI Key: | GMVAGXODPOCFFY-UHFFFAOYSA-N |