2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]ethan-1-one
Chemical Structure Depiction of
2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]ethan-1-one
2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | S565-1294 |
| Compound Name: | 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]ethan-1-one |
| Molecular Weight: | 487.28 |
| Molecular Formula: | C17 H18 Br F3 N8 O |
| Smiles: | Cc1c(c(C(F)(F)F)nn1CC(N1CCc2c(C1)c(c1nncn1C)nn2C)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 0.2262 |
| logD: | 0.221 |
| logSw: | -0.1198 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 70.698 |
| InChI Key: | JTFONZTWTUWHPG-UHFFFAOYSA-N |