N-[3-(2-ethylpiperidin-1-yl)propyl]-N~2~-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)glycinamide
Chemical Structure Depiction of
N-[3-(2-ethylpiperidin-1-yl)propyl]-N~2~-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)glycinamide
N-[3-(2-ethylpiperidin-1-yl)propyl]-N~2~-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)glycinamide
Compound characteristics
| Compound ID: | K784-8924 |
| Compound Name: | N-[3-(2-ethylpiperidin-1-yl)propyl]-N~2~-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)glycinamide |
| Molecular Weight: | 459.65 |
| Molecular Formula: | C24 H37 N5 O2 S |
| Smiles: | CCC1CCCCN1CCCNC(CNC(N1CC2CC(C1)C1=CC=CC(N1C2)=O)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5823 |
| logD: | -0.3427 |
| logSw: | -2.7478 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.265 |
| InChI Key: | ORFAJBZOMAGGQA-UHFFFAOYSA-N |