1-benzyl-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Chemical Structure Depiction of
1-benzyl-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
1-benzyl-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Compound characteristics
| Compound ID: | 8012-0482 |
| Compound Name: | 1-benzyl-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one |
| Molecular Weight: | 398.76 |
| Molecular Formula: | C20 H22 Cl3 N O |
| Smiles: | Cc1c(CC([Cl])([Cl])[Cl])c2C(CC(C)(C)Cc2n1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6075 |
| logD: | 5.6075 |
| logSw: | -6.0739 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 15.0891 |
| InChI Key: | MUKORLJEKLUXDU-UHFFFAOYSA-N |