N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)-3-phenylpropanamide
Chemical Structure Depiction of
N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)-3-phenylpropanamide
N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | D433-0763 |
| Compound Name: | N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)-3-phenylpropanamide |
| Molecular Weight: | 401.47 |
| Molecular Formula: | C23 H23 N5 O2 |
| Smiles: | CC1=CC(n2c(N1)nc(CN(C(CCc1ccccc1)=O)c1ccc(C)cc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5404 |
| logD: | 0.8878 |
| logSw: | -3.6892 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.819 |
| InChI Key: | NIMUQEGOOPUVGZ-UHFFFAOYSA-N |