N-[2-(3,4-diethoxyphenyl)ethyl]-1-(piperidin-1-yl)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-1-(piperidin-1-yl)isoquinoline-4-carboxamide
N-[2-(3,4-diethoxyphenyl)ethyl]-1-(piperidin-1-yl)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | G817-0619 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-1-(piperidin-1-yl)isoquinoline-4-carboxamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Smiles: | CCOc1ccc(CCNC(c2cnc(c3ccccc23)N2CCCCC2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.6345 |
| logD: | 4.6269 |
| logSw: | -4.0464 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.165 |
| InChI Key: | ISYVOHQFEVSNGX-UHFFFAOYSA-N |