2-{[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y503-3328 |
| Compound Name: | 2-{[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 401.15 |
| Molecular Formula: | C12 H8 Br F3 N8 |
| Smiles: | Cc1c(c(C(F)(F)F)nn1Cc1nc2c3cn[nH]c3ncn2n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.3235 |
| logD: | 1.1079 |
| logSw: | -1.7936 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.484 |
| InChI Key: | BOTDFUKSWUDKSV-UHFFFAOYSA-N |