N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y508-7427 |
| Compound Name: | N-[3-(4-bromophenoxy)-5-nitrophenyl]-5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 681.26 |
| Molecular Formula: | C26 H18 Br2 F3 N5 O4 |
| Smiles: | C1C(c2ccc(cc2)[Br])Nc2c(cnn2C1C(F)(F)F)C(Nc1cc(cc(c1)Oc1ccc(cc1)[Br])[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 7.8995 |
| logD: | 7.8962 |
| logSw: | -6.0113 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.734 |
| InChI Key: | MUKBOSDASHUHSM-UHFFFAOYSA-N |