rel-(5R,7S)-3-bromo-5-(5-bromofuran-2-yl)-N-(2-ethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-3-bromo-5-(5-bromofuran-2-yl)-N-(2-ethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
rel-(5R,7S)-3-bromo-5-(5-bromofuran-2-yl)-N-(2-ethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | 3209-1402 |
Compound Name: | rel-(5R,7S)-3-bromo-5-(5-bromofuran-2-yl)-N-(2-ethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 562.18 |
Molecular Formula: | C20 H17 Br2 F3 N4 O2 |
Smiles: | CCc1ccccc1NC(c1c(c2N[C@H](C[C@@H](C(F)(F)F)n2n1)c1ccc(o1)[Br])[Br])=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 5.7876 |
logD: | 5.7876 |
logSw: | -5.5388 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.38 |
InChI Key: | WCFVIJJMPFFTTL-TZMCWYRMSA-N |