2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D643-0097 |
| Compound Name: | 2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 481.46 |
| Molecular Formula: | C22 H14 F3 N7 O S |
| Smiles: | Cc1cc(C(F)(F)F)nc2c1c1c(c3nc(c4cc(c5ccc(cc5)OC)n[nH]4)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.6353 |
| logD: | 5.6281 |
| logSw: | -5.8819 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.254 |
| InChI Key: | AQKRSHROUGOOCV-UHFFFAOYSA-N |