rel-(5R,7S)-N-benzyl-3-bromo-5-(5-bromofuran-2-yl)-N-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-N-benzyl-3-bromo-5-(5-bromofuran-2-yl)-N-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
rel-(5R,7S)-N-benzyl-3-bromo-5-(5-bromofuran-2-yl)-N-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 3209-1422 |
| Compound Name: | rel-(5R,7S)-N-benzyl-3-bromo-5-(5-bromofuran-2-yl)-N-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 624.25 |
| Molecular Formula: | C25 H19 Br2 F3 N4 O2 |
| Smiles: | C1[C@@H](C(F)(F)F)n2c(c(c(C(N(Cc3ccccc3)c3ccccc3)=O)n2)[Br])N[C@H]1c1ccc(o1)[Br] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 6.6025 |
| logD: | 6.6025 |
| logSw: | -6.031 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.338 |
| InChI Key: | YRMCLUUHAPIEDQ-IEBWSBKVSA-N |