N-(butan-2-yl)-2-({6-methyl-4-[(4-methylphenyl)methyl]-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(butan-2-yl)-2-({6-methyl-4-[(4-methylphenyl)methyl]-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
N-(butan-2-yl)-2-({6-methyl-4-[(4-methylphenyl)methyl]-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | L683-0407 |
| Compound Name: | N-(butan-2-yl)-2-({6-methyl-4-[(4-methylphenyl)methyl]-5-oxo-5,6-dihydro-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl}sulfanyl)acetamide |
| Molecular Weight: | 439.54 |
| Molecular Formula: | C21 H25 N7 O2 S |
| Smiles: | CCC(C)NC(CSc1nnc2N(Cc3ccc(C)cc3)C(c3c(cnn3C)n12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1203 |
| logD: | 2.1203 |
| logSw: | -2.5859 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.624 |
| InChI Key: | UODMCJPSIKGLSL-AWEZNQCLSA-N |