N-(3-methoxy-5-nitrophenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3-methoxy-5-nitrophenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-(3-methoxy-5-nitrophenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | 3209-0332 |
Compound Name: | N-(3-methoxy-5-nitrophenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 471.39 |
Molecular Formula: | C22 H16 F3 N5 O4 |
Smiles: | Cc1ccc(cc1)c1cc(C(F)(F)F)n2c(cc(C(Nc3cc(cc(c3)OC)[N+]([O-])=O)=O)n2)n1 |
Stereo: | ACHIRAL |
logP: | 5.6663 |
logD: | 5.6397 |
logSw: | -5.4447 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.414 |
InChI Key: | LVBIMBSHXLONLF-UHFFFAOYSA-N |