3-(heptafluoropropyl)-5,5-dimethyl-2,3,5,6-tetrahydro[1,2,4]triazolo[3,4-a]isoquinolin-3-ol
Chemical Structure Depiction of
3-(heptafluoropropyl)-5,5-dimethyl-2,3,5,6-tetrahydro[1,2,4]triazolo[3,4-a]isoquinolin-3-ol
3-(heptafluoropropyl)-5,5-dimethyl-2,3,5,6-tetrahydro[1,2,4]triazolo[3,4-a]isoquinolin-3-ol
Compound characteristics
| Compound ID: | 8009-0939 |
| Compound Name: | 3-(heptafluoropropyl)-5,5-dimethyl-2,3,5,6-tetrahydro[1,2,4]triazolo[3,4-a]isoquinolin-3-ol |
| Molecular Weight: | 385.28 |
| Molecular Formula: | C15 H14 F7 N3 O |
| Smiles: | CC1(C)Cc2ccccc2C2=NNC(C(C(C(F)(F)F)(F)F)(F)F)(N12)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2421 |
| logD: | 3.4399 |
| logSw: | -4.3084 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.063 |
| InChI Key: | VISLAHYTTBTJPT-HNNXBMFYSA-N |