3-bromo-N-(2-chloro-4-nitrophenyl)-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
3-bromo-N-(2-chloro-4-nitrophenyl)-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
3-bromo-N-(2-chloro-4-nitrophenyl)-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 1890-0396 |
| Compound Name: | 3-bromo-N-(2-chloro-4-nitrophenyl)-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 570.71 |
| Molecular Formula: | C21 H12 Br Cl F3 N5 O4 |
| Smiles: | COc1ccc(cc1)c1cc(C(F)(F)F)n2c(c(c(C(Nc3ccc(cc3[Cl])[N+]([O-])=O)=O)n2)[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0563 |
| logD: | 5.054 |
| logSw: | -6.2589 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.033 |
| InChI Key: | SJMVRVLUVMALSC-UHFFFAOYSA-N |