3,6,6-trimethyl-1-[2-(propan-2-yl)phenyl]-1,5,6,7-tetrahydro-4H-indazol-4-one
Chemical Structure Depiction of
3,6,6-trimethyl-1-[2-(propan-2-yl)phenyl]-1,5,6,7-tetrahydro-4H-indazol-4-one
3,6,6-trimethyl-1-[2-(propan-2-yl)phenyl]-1,5,6,7-tetrahydro-4H-indazol-4-one
Compound characteristics
| Compound ID: | 8012-5685 |
| Compound Name: | 3,6,6-trimethyl-1-[2-(propan-2-yl)phenyl]-1,5,6,7-tetrahydro-4H-indazol-4-one |
| Molecular Weight: | 296.41 |
| Molecular Formula: | C19 H24 N2 O |
| Smiles: | CC(C)c1ccccc1n1c2CC(C)(C)CC(c2c(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6794 |
| logD: | 3.6794 |
| logSw: | -4.3165 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.5087 |
| InChI Key: | RROVOWDNOQXZJY-UHFFFAOYSA-N |