N-benzyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-benzyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-benzyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0946 |
| Compound Name: | N-benzyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 441.37 |
| Molecular Formula: | C21 H14 F3 N5 O3 |
| Smiles: | C(c1ccccc1)NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6783 |
| logD: | 4.6783 |
| logSw: | -4.8583 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.192 |
| InChI Key: | IWSJMHUFSAANET-UHFFFAOYSA-N |