N-(6-benzyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-methyl-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of
N-(6-benzyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-methyl-N-[(4-methylphenyl)methyl]butanamide
N-(6-benzyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-methyl-N-[(4-methylphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | D524-2725 |
| Compound Name: | N-(6-benzyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-methyl-N-[(4-methylphenyl)methyl]butanamide |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C26 H29 N5 O2 |
| Smiles: | [H]C([H])(C1=C(C)Nc2nc(nn2C1=O)N(C(CC(C)C)=O)C([H])([H])c1ccc(C)cc1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2848 |
| logD: | 5.2691 |
| logSw: | -5.1072 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.274 |
| InChI Key: | UTLCRHDDTMPJPZ-UHFFFAOYSA-N |