N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-3-phenylprop-2-enamide
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | 8014-5230 |
| Compound Name: | N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-3-phenylprop-2-enamide |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C29 H28 N2 O5 |
| Smiles: | COc1cc(Cc2c3cc(c(cc3ccn2)OC)OC)c(cc1OC)NC(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8543 |
| logD: | 4.8459 |
| logSw: | -4.7111 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.71 |
| InChI Key: | RPBJCYRMZMIHEU-UHFFFAOYSA-N |