2-({1-[3-(3,4-dimethoxyphenyl)prop-2-enoyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-({1-[3-(3,4-dimethoxyphenyl)prop-2-enoyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-({1-[3-(3,4-dimethoxyphenyl)prop-2-enoyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3341-3957 |
| Compound Name: | 2-({1-[3-(3,4-dimethoxyphenyl)prop-2-enoyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C29 H28 N2 O5 |
| Smiles: | COc1ccc(/C=C/C(N2CCC(CC2)CN2C(c3cccc4cccc(C2=O)c34)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.3891 |
| logD: | 4.389 |
| logSw: | -4.7503 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.236 |
| InChI Key: | WIPTZWOLPNMQDW-UHFFFAOYSA-N |