4-[(2H-1,3-benzodioxol-5-yl)methyl]-4',4'-dimethyl-3,4-dihydro-1H-spiro[benzo[f]quinoline-2,1'-cyclohexane]-2',6'-dione
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methyl]-4',4'-dimethyl-3,4-dihydro-1H-spiro[benzo[f]quinoline-2,1'-cyclohexane]-2',6'-dione
4-[(2H-1,3-benzodioxol-5-yl)methyl]-4',4'-dimethyl-3,4-dihydro-1H-spiro[benzo[f]quinoline-2,1'-cyclohexane]-2',6'-dione
Compound characteristics
| Compound ID: | 8018-6274 |
| Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methyl]-4',4'-dimethyl-3,4-dihydro-1H-spiro[benzo[f]quinoline-2,1'-cyclohexane]-2',6'-dione |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C28 H27 N O4 |
| Smiles: | CC1(C)CC(C2(Cc3c(ccc4ccccc34)N(Cc3ccc4c(c3)OCO4)C2)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.991 |
| logD: | 4.991 |
| logSw: | -5.7011 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.995 |
| InChI Key: | TYHCKQIXXFAOLJ-UHFFFAOYSA-N |