5-(3,4-dimethoxyphenyl)-N-(3-nitro-5-phenoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-N-(3-nitro-5-phenoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
5-(3,4-dimethoxyphenyl)-N-(3-nitro-5-phenoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 3209-0700 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-N-(3-nitro-5-phenoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 583.52 |
| Molecular Formula: | C28 H24 F3 N5 O6 |
| Smiles: | COc1ccc(cc1OC)C1CC(C(F)(F)F)n2c(cc(C(Nc3cc(cc(c3)Oc3ccccc3)[N+]([O-])=O)=O)n2)N1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.9713 |
| logD: | 5.9703 |
| logSw: | -5.5611 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.248 |
| InChI Key: | QSURYZRNYGKARA-UHFFFAOYSA-N |