N-(6-butyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methyl-N-[(4-methylphenyl)methyl]propanamide
Chemical Structure Depiction of
N-(6-butyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methyl-N-[(4-methylphenyl)methyl]propanamide
N-(6-butyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methyl-N-[(4-methylphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | D524-2927 |
| Compound Name: | N-(6-butyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-methyl-N-[(4-methylphenyl)methyl]propanamide |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C22 H29 N5 O2 |
| Smiles: | [H]C([H])(CCC)C1=C(C)Nc2nc(nn2C1=O)N(C(C(C)C)=O)C([H])([H])c1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9735 |
| logD: | 4.9262 |
| logSw: | -4.4453 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.073 |
| InChI Key: | IODNMHLJXJKKPF-UHFFFAOYSA-N |