2-{[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-4098 |
| Compound Name: | 2-{[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 416.34 |
| Molecular Formula: | C18 H12 F4 N8 |
| Smiles: | C(c1nc2c3cnn(c4ccccc4)c3ncn2n1)n1c(cc(C(F)F)n1)C(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.1067 |
| logD: | 2.0981 |
| logSw: | -2.284 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 58.662 |
| InChI Key: | AUCUVJPNCRFGGF-UHFFFAOYSA-N |