2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-N-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-N-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-N-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C080-0012 |
| Compound Name: | 2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-N-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 512.48 |
| Molecular Formula: | C27 H23 F3 N2 O5 |
| Smiles: | CCOc1ccc(cc1)N1C=C(C(Nc2cccc(c2)C(F)(F)F)=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.1885 |
| logD: | 5.1694 |
| logSw: | -5.1179 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.23 |
| InChI Key: | LDAWTOJOJPMVPE-UHFFFAOYSA-N |