3-methyl-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)butanamide
Chemical Structure Depiction of
3-methyl-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)butanamide
3-methyl-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)butanamide
Compound characteristics
| Compound ID: | D433-0786 |
| Compound Name: | 3-methyl-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)butanamide |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C19 H23 N5 O2 |
| Smiles: | CC(C)CC(N(Cc1nc2NC(C)=CC(n2n1)=O)c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7299 |
| logD: | 0.0773 |
| logSw: | -3.1389 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.091 |
| InChI Key: | CGWOQIJLRMXEQI-UHFFFAOYSA-N |