N-[3-(4-bromophenoxy)-5-nitrophenyl]-3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromophenoxy)-5-nitrophenyl]-3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
N-[3-(4-bromophenoxy)-5-nitrophenyl]-3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 3209-1160 |
| Compound Name: | N-[3-(4-bromophenoxy)-5-nitrophenyl]-3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 666.84 |
| Molecular Formula: | C27 H20 Br Cl F3 N5 O5 |
| Smiles: | COc1ccc(cc1)C1CC(C(F)(F)F)n2c(c(c(C(Nc3cc(cc(c3)Oc3ccc(cc3)[Br])[N+]([O-])=O)=O)n2)[Cl])N1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 7.7579 |
| logD: | 7.7496 |
| logSw: | -6.7578 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.825 |
| InChI Key: | BETFYNBAUVZZSY-UHFFFAOYSA-N |