4-(3,5-dimethylpiperidine-1-carbonyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(3,5-dimethylpiperidine-1-carbonyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-3,4-dihydroisoquinolin-1(2H)-one
4-(3,5-dimethylpiperidine-1-carbonyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C294-0320 |
| Compound Name: | 4-(3,5-dimethylpiperidine-1-carbonyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C28 H33 N3 O3 |
| Smiles: | CC1CC(C)CN(C1)C(C1C(c2c[nH]c3ccccc23)N(CCOC)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2309 |
| logD: | 4.2309 |
| logSw: | -4.1047 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.63 |
| InChI Key: | OPZRZLOCRNDLOU-UHFFFAOYSA-N |