7-[3,4-bis(difluoromethoxy)phenyl]-5-(4-iodophenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-[3,4-bis(difluoromethoxy)phenyl]-5-(4-iodophenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
7-[3,4-bis(difluoromethoxy)phenyl]-5-(4-iodophenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-4652 |
| Compound Name: | 7-[3,4-bis(difluoromethoxy)phenyl]-5-(4-iodophenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 534.25 |
| Molecular Formula: | C19 H15 F4 I N4 O2 |
| Smiles: | C1C(c2ccc(cc2)I)Nc2ncnn2C1c1ccc(c(c1)OC(F)F)OC(F)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8555 |
| logD: | 4.8554 |
| logSw: | -4.9676 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.452 |
| InChI Key: | PWZLDBGVIWBDEZ-UHFFFAOYSA-N |