N-benzyl-3-(2-phenylethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-benzyl-3-(2-phenylethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-benzyl-3-(2-phenylethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V020-6854 |
| Compound Name: | N-benzyl-3-(2-phenylethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C28 H31 N3 O |
| Salt: | not_available |
| Smiles: | C(CN1CCN2C(C1)C(Cc1ccccc12)C(NCc1ccccc1)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2003 |
| logD: | 2.9924 |
| logSw: | -4.1954 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.4752 |
| InChI Key: | JFFQKHVYNGGCSQ-UHFFFAOYSA-N |