3-[1,3-dioxo-6-(piperidin-1-yl)-1H-benzo[de]isoquinolin-2(3H)-yl]propyl 2,4-dichlorobenzoate
Chemical Structure Depiction of
3-[1,3-dioxo-6-(piperidin-1-yl)-1H-benzo[de]isoquinolin-2(3H)-yl]propyl 2,4-dichlorobenzoate
3-[1,3-dioxo-6-(piperidin-1-yl)-1H-benzo[de]isoquinolin-2(3H)-yl]propyl 2,4-dichlorobenzoate
Compound characteristics
| Compound ID: | 1189-2481 |
| Compound Name: | 3-[1,3-dioxo-6-(piperidin-1-yl)-1H-benzo[de]isoquinolin-2(3H)-yl]propyl 2,4-dichlorobenzoate |
| Molecular Weight: | 511.4 |
| Molecular Formula: | C27 H24 Cl2 N2 O4 |
| Smiles: | C1CCN(CC1)c1ccc2C(N(CCCOC(c3ccc(cc3[Cl])[Cl])=O)C(c3cccc1c23)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6761 |
| logD: | 6.6761 |
| logSw: | -6.5927 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.032 |
| InChI Key: | MKHJGWWAOACYLT-UHFFFAOYSA-N |