1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propan-1-one
Compound characteristics
| Compound ID: | C999-0159 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propan-1-one |
| Molecular Weight: | 452.6 |
| Molecular Formula: | C29 H32 N4 O |
| Smiles: | Cc1ccc(cc1C)n1c2c(c(C)c(CCC(N3CCc4ccccc4C3)=O)c(C)n2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.9123 |
| logD: | 5.8999 |
| logSw: | -5.8523 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.994 |
| InChI Key: | MYILEZVOERBFQE-UHFFFAOYSA-N |