Information card for entry 7121918
| Chemical name |
N-((1-butylpiperidin-4-yl)methyl)-8-hydroxyquinoline-2-carboxamide hydrate |
| Formula |
C20 H29 N3 O3 |
| Calculated formula |
C20 H29 N3 O3 |
| Title of publication |
Development of subnanomolar-affinity serotonin 5-HT<sub>4</sub> receptor ligands based on quinoline structures. |
| Authors of publication |
Castriconi, Federica; Paolino, Marco; Grisci, Giorgio; Francini, Cinzia Maria; Reale, Annalisa; Giuliani, Germano; Anzini, Maurizio; Giorgi, Gianluca; Mennuni, Laura; Sabatini, Chiara; Lanza, Marco; Caselli, Gianfranco; Cappelli, Andrea |
| Journal of publication |
MedChemComm |
| Year of publication |
2018 |
| Journal volume |
9 |
| Journal issue |
9 |
| Pages of publication |
1466 - 1471 |
| a |
11.3833 ± 0.0006 Å |
| b |
11.7128 ± 0.0006 Å |
| c |
15.0977 ± 0.0008 Å |
| α |
90° |
| β |
103.83 ± 0.006° |
| γ |
90° |
| Cell volume |
1954.62 ± 0.18 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/c 1 |
| Hall space group symbol |
-P 2ybc |
| Residual factor for all reflections |
0.1215 |
| Residual factor for significantly intense reflections |
0.0448 |
| Weighted residual factors for significantly intense reflections |
0.0853 |
| Weighted residual factors for all reflections included in the refinement |
0.0969 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.766 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
For the version history of this entry, please navigate to main COD server.
The link is:
https://www.crystallography.net/7121918.html
