6-methyl-4-[(4-methylphenyl)methyl]-1-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-5(6H)-one
Chemical Structure Depiction of
6-methyl-4-[(4-methylphenyl)methyl]-1-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-5(6H)-one
6-methyl-4-[(4-methylphenyl)methyl]-1-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-5(6H)-one
Compound characteristics
| Compound ID: | L683-0408 |
| Compound Name: | 6-methyl-4-[(4-methylphenyl)methyl]-1-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4H-pyrazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrimidin-5(6H)-one |
| Molecular Weight: | 465.58 |
| Molecular Formula: | C23 H27 N7 O2 S |
| Smiles: | CC1CCN(CC1)C(CSc1nnc2N(Cc3ccc(C)cc3)C(c3c(cnn3C)n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5663 |
| logD: | 2.5663 |
| logSw: | -2.55 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.832 |
| InChI Key: | FVWJCVCCDALMIT-UHFFFAOYSA-N |