2-[1-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)butylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[1-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)butylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[1-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)butylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 8014-2756 |
| Compound Name: | 2-[1-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)butylidene]-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 472.63 |
| Molecular Formula: | C30 H36 N2 O3 |
| Smiles: | CCCC(=C1C(CC(C)(C)CC1=O)=O)NCCc1c2cc(ccc2[nH]c1C)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7772 |
| logD: | 5.7464 |
| logSw: | -5.6482 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.661 |
| InChI Key: | MRVSGPJWBKMVOK-UHFFFAOYSA-N |