N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-3-chloro-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-3-chloro-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-3-chloro-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0917 |
| Compound Name: | N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-3-chloro-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 711.68 |
| Molecular Formula: | C26 H13 Br2 Cl F3 N5 O4 |
| Smiles: | c1cc(ccc1c1cc(C(F)(F)F)n2c(c(c(C(Nc3cc(cc(c3)Oc3ccc(cc3)[Br])[N+]([O-])=O)=O)n2)[Cl])n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 9.1167 |
| logD: | 9.0951 |
| logSw: | -7.0661 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.935 |
| InChI Key: | FVDSLRDHXFLGEH-UHFFFAOYSA-N |