5,5-dimethyl-2-(3,3,6,7-tetramethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)cyclohexane-1,3-dione
Chemical Structure Depiction of
5,5-dimethyl-2-(3,3,6,7-tetramethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)cyclohexane-1,3-dione
5,5-dimethyl-2-(3,3,6,7-tetramethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 8006-6882 |
| Compound Name: | 5,5-dimethyl-2-(3,3,6,7-tetramethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)cyclohexane-1,3-dione |
| Molecular Weight: | 325.45 |
| Molecular Formula: | C21 H27 N O2 |
| Smiles: | Cc1cc2CC(C)(C)NC(=C3C(CC(C)(C)CC3=O)=O)c2cc1C |
| Stereo: | ACHIRAL |
| logP: | 4.3563 |
| logD: | 3.9558 |
| logSw: | -4.3017 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.098 |
| InChI Key: | QAUCLGSNHXQMAY-UHFFFAOYSA-N |