2-[4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y501-0671 |
| Compound Name: | 2-[4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 518.26 |
| Molecular Formula: | C17 H9 Br F5 N7 S |
| Smiles: | Cc1cc(C(F)F)nc2c1c1c(c3nc(c4c(c(C(F)(F)F)n(C)n4)[Br])nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.1211 |
| logD: | 4.1195 |
| logSw: | -4.4938 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.283 |
| InChI Key: | KSQXERPBHCOTLF-UHFFFAOYSA-N |