N-(butan-2-yl)-2-[5-methyl-2-(4-methylphenyl)-7-oxo-4-(prop-2-en-1-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-(butan-2-yl)-2-[5-methyl-2-(4-methylphenyl)-7-oxo-4-(prop-2-en-1-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide
N-(butan-2-yl)-2-[5-methyl-2-(4-methylphenyl)-7-oxo-4-(prop-2-en-1-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | D584-0485 |
| Compound Name: | N-(butan-2-yl)-2-[5-methyl-2-(4-methylphenyl)-7-oxo-4-(prop-2-en-1-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 393.49 |
| Molecular Formula: | C22 H27 N5 O2 |
| Smiles: | [H]C([H])(C=C)N1C(C)=C(CC(NC(C)CC)=O)C(n2c1nc(c1ccc(C)cc1)n2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.554 |
| logD: | 3.554 |
| logSw: | -3.5248 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.645 |
| InChI Key: | CDVYOHIKHHFLRG-HNNXBMFYSA-N |