4-tert-butyl-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(pyridin-3-yl)ethyl]benzamide
Chemical Structure Depiction of
4-tert-butyl-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(pyridin-3-yl)ethyl]benzamide
4-tert-butyl-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(pyridin-3-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | E155-1058 |
| Compound Name: | 4-tert-butyl-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(pyridin-3-yl)ethyl]benzamide |
| Molecular Weight: | 413.56 |
| Molecular Formula: | C27 H31 N3 O |
| Smiles: | CC(C)(C)c1ccc(cc1)C(NCC(c1cccnc1)N1CCc2ccccc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8927 |
| logD: | 4.8905 |
| logSw: | -4.1036 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.821 |
| InChI Key: | CUZLPWPPBUJSMW-VWLOTQADSA-N |