4-(3,5-dimethylpiperidine-1-carbonyl)-6,7-dimethoxy-2-methyl-3-(pyridin-3-yl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(3,5-dimethylpiperidine-1-carbonyl)-6,7-dimethoxy-2-methyl-3-(pyridin-3-yl)-3,4-dihydroisoquinolin-1(2H)-one
4-(3,5-dimethylpiperidine-1-carbonyl)-6,7-dimethoxy-2-methyl-3-(pyridin-3-yl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C125-0511 |
| Compound Name: | 4-(3,5-dimethylpiperidine-1-carbonyl)-6,7-dimethoxy-2-methyl-3-(pyridin-3-yl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C25 H31 N3 O4 |
| Smiles: | CC1CC(C)CN(C1)C(C1C(c2cccnc2)N(C)C(c2cc(c(cc12)OC)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3776 |
| logD: | 2.3776 |
| logSw: | -2.6321 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.982 |
| InChI Key: | AJQUPUDDSQWYMM-UHFFFAOYSA-N |