N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | K061-0852 |
| Compound Name: | N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 677.23 |
| Molecular Formula: | C26 H14 Br2 F3 N5 O4 |
| Smiles: | c1cc(ccc1c1cc(C(F)(F)F)n2c(c(cn2)C(Nc2cc(cc(c2)Oc2ccc(cc2)[Br])[N+]([O-])=O)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 8.4069 |
| logD: | 8.3954 |
| logSw: | -6.1693 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.388 |
| InChI Key: | VELMNJQTCQNQCA-UHFFFAOYSA-N |