2-(4-ethoxyphenyl)-6,7-dimethoxy-4-(3-methylpiperidine-1-carbonyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-6,7-dimethoxy-4-(3-methylpiperidine-1-carbonyl)isoquinolin-1(2H)-one
2-(4-ethoxyphenyl)-6,7-dimethoxy-4-(3-methylpiperidine-1-carbonyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C080-0059 |
| Compound Name: | 2-(4-ethoxyphenyl)-6,7-dimethoxy-4-(3-methylpiperidine-1-carbonyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 450.53 |
| Molecular Formula: | C26 H30 N2 O5 |
| Smiles: | CCOc1ccc(cc1)N1C=C(C(N2CCCC(C)C2)=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6908 |
| logD: | 3.6908 |
| logSw: | -3.8408 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.721 |
| InChI Key: | MYXYNLZVFHQMIP-KRWDZBQOSA-N |