9-(difluoromethyl)-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
9-(difluoromethyl)-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
9-(difluoromethyl)-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D643-0137 |
| Compound Name: | 9-(difluoromethyl)-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 451.43 |
| Molecular Formula: | C21 H12 F3 N7 S |
| Smiles: | Cc1cc(C(F)F)nc2c1c1c(c3nc(c4cc(c5ccc(cc5)F)n[nH]4)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.0913 |
| logD: | 5.0841 |
| logSw: | -5.1803 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.71 |
| InChI Key: | RSXUFJVZGRLTFE-UHFFFAOYSA-N |