6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-N-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-N-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-N-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C168-0426 |
| Compound Name: | 6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-N-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 448.44 |
| Molecular Formula: | C23 H23 F3 N2 O4 |
| Smiles: | CC(C)CN1C=C(C(Nc2cccc(c2)C(F)(F)F)=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.7581 |
| logD: | 4.5872 |
| logSw: | -4.5364 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.824 |
| InChI Key: | PMZCSCUHFQZJLV-UHFFFAOYSA-N |