rel-(5R,7S)-7-[4-(difluoromethoxy)phenyl]-5-(4-methoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
rel-(5R,7S)-7-[4-(difluoromethoxy)phenyl]-5-(4-methoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
rel-(5R,7S)-7-[4-(difluoromethoxy)phenyl]-5-(4-methoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Compound characteristics
Compound ID: | K832-4081 |
Compound Name: | rel-(5R,7S)-7-[4-(difluoromethoxy)phenyl]-5-(4-methoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine |
Molecular Weight: | 373.36 |
Molecular Formula: | C18 H17 F2 N5 O2 |
Smiles: | COc1ccc(cc1)[C@@H]1C[C@H](c2ccc(cc2)OC(F)F)n2c(N1)nnn2 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 3.1328 |
logD: | 3.1328 |
logSw: | -3.2767 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.694 |
InChI Key: | QUJIBASAZIUATP-HOTGVXAUSA-N |