4-benzyl-5-[6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridin-4-yl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-benzyl-5-[6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridin-4-yl]-4H-1,2,4-triazole-3-thiol
4-benzyl-5-[6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridin-4-yl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-7460 |
| Compound Name: | 4-benzyl-5-[6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridin-4-yl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 458.59 |
| Molecular Formula: | C24 H26 N8 S |
| Smiles: | CCCn1c2c(c(cc(c3cnn(C)c3C)n2)c2nnc(n2Cc2ccccc2)S)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7909 |
| logD: | 2.8831 |
| logSw: | -4.0623 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.439 |
| InChI Key: | DUUHWLLWEPRCDH-UHFFFAOYSA-N |