3-phenyl-N-[2-(thiophen-2-yl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-phenyl-N-[2-(thiophen-2-yl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-phenyl-N-[2-(thiophen-2-yl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V017-7871 |
| Compound Name: | 3-phenyl-N-[2-(thiophen-2-yl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C25 H27 N3 O S |
| Salt: | not_available |
| Smiles: | C(CNC(C1Cc2ccccc2N2CCN(CC12)c1ccccc1)=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3997 |
| logD: | 4.3994 |
| logSw: | -4.2243 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.0766 |
| InChI Key: | WERLAYFZGCUBCL-UHFFFAOYSA-N |