7-(difluoromethyl)-5-(4-methylphenyl)-N-[3-nitro-5-(2,2,3,3-tetrafluoropropoxy)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
7-(difluoromethyl)-5-(4-methylphenyl)-N-[3-nitro-5-(2,2,3,3-tetrafluoropropoxy)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
7-(difluoromethyl)-5-(4-methylphenyl)-N-[3-nitro-5-(2,2,3,3-tetrafluoropropoxy)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y500-9012 |
| Compound Name: | 7-(difluoromethyl)-5-(4-methylphenyl)-N-[3-nitro-5-(2,2,3,3-tetrafluoropropoxy)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 553.42 |
| Molecular Formula: | C24 H17 F6 N5 O4 |
| Smiles: | Cc1ccc(cc1)c1cc(C(F)F)n2c(c(cn2)C(Nc2cc(cc(c2)OCC(C(F)F)(F)F)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6179 |
| logD: | 5.5079 |
| logSw: | -5.2778 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.14 |
| InChI Key: | KCXGRWMYAGXFET-UHFFFAOYSA-N |