{1-methyl-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(2-methylphenyl)methanone
Chemical Structure Depiction of
{1-methyl-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(2-methylphenyl)methanone
{1-methyl-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(2-methylphenyl)methanone
Compound characteristics
| Compound ID: | L886-0214 |
| Compound Name: | {1-methyl-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(2-methylphenyl)methanone |
| Molecular Weight: | 382.49 |
| Molecular Formula: | C19 H22 N6 O S |
| Smiles: | Cc1ccccc1C(N1CCc2c(C1)c(c1nnc(n1C)SC)nn2C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5169 |
| logD: | 1.5048 |
| logSw: | -2.3935 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.65 |
| InChI Key: | CKAVOZPNBYQHBD-UHFFFAOYSA-N |