9-(difluoromethyl)-2-[3-(4-ethoxyphenyl)-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-ethoxyphenyl)-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-ethoxyphenyl)-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: | D643-0139 |
| Compound Name: | 9-(difluoromethyl)-2-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 477.49 |
| Molecular Formula: | C23 H17 F2 N7 O S |
| Smiles: | CCOc1ccc(cc1)c1cc(c2nc3c4c(c5c(C)cc(C(F)F)nc5s4)ncn3n2)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 5.4312 |
| logD: | 5.424 |
| logSw: | -5.6462 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.834 |
| InChI Key: | ZOKPKWDTWIMDAI-UHFFFAOYSA-N |