ethyl 7-(difluoromethyl)-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 7-(difluoromethyl)-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
ethyl 7-(difluoromethyl)-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
Compound characteristics
Compound ID: | 7213-0784 |
Compound Name: | ethyl 7-(difluoromethyl)-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate |
Molecular Weight: | 321.32 |
Molecular Formula: | C16 H17 F2 N3 O2 |
Smiles: | CCOC(c1cnn2C(CC(c3ccccc3)Nc12)C(F)F)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 3.0914 |
logD: | 3.0914 |
logSw: | -3.1718 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.268 |
InChI Key: | HZUMEWYPZWQXIZ-UHFFFAOYSA-N |