3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{1-methyl-3-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}propan-1-one
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{1-methyl-3-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}propan-1-one
3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{1-methyl-3-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}propan-1-one
Compound characteristics
| Compound ID: | S565-0758 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{1-methyl-3-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}propan-1-one |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C20 H28 N8 O |
| Smiles: | CC(C)n1cnnc1c1c2CN(CCc2n(C)n1)C(CCn1c(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1831 |
| logD: | -0.2348 |
| logSw: | -0.4742 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 70.172 |
| InChI Key: | KXTBUQBPNNFXNL-UHFFFAOYSA-N |