1-(4-ethoxyphenyl)-3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Chemical Structure Depiction of
1-(4-ethoxyphenyl)-3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one
1-(4-ethoxyphenyl)-3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Compound characteristics
| Compound ID: | P773-1099 |
| Compound Name: | 1-(4-ethoxyphenyl)-3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one |
| Molecular Weight: | 298.38 |
| Molecular Formula: | C18 H22 N2 O2 |
| Smiles: | CCOc1ccc(cc1)n1c2CC(C)(C)CC(c2c(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.046 |
| logD: | 3.046 |
| logSw: | -3.2513 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.933 |
| InChI Key: | BTRXLMNTVCHIPW-UHFFFAOYSA-N |