N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0801 |
| Compound Name: | N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 677.23 |
| Molecular Formula: | C26 H14 Br2 F3 N5 O4 |
| Smiles: | c1cc(ccc1c1cc(C(F)(F)F)n2c(cc(C(Nc3cc(cc(c3)Oc3ccc(cc3)[Br])[N+]([O-])=O)=O)n2)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 8.5417 |
| logD: | 8.5391 |
| logSw: | -6.2793 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.618 |
| InChI Key: | CMWXXCSNXOHUCL-UHFFFAOYSA-N |