4-(3,5-dimethylpiperidine-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(3,5-dimethylpiperidine-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1(2H)-one
4-(3,5-dimethylpiperidine-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C138-0649 |
| Compound Name: | 4-(3,5-dimethylpiperidine-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 454.54 |
| Molecular Formula: | C26 H31 F N2 O4 |
| Smiles: | CC1CC(C)CN(C1)C(C1C(c2ccccc2F)N(C)C(c2cc(c(cc12)OC)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6773 |
| logD: | 3.6773 |
| logSw: | -3.9622 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.464 |
| InChI Key: | QFWNWCCMZFCOQU-UHFFFAOYSA-N |