3-[(4-chlorophenyl)methyl]-N-ethyl-9-methoxy-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-N-ethyl-9-methoxy-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-[(4-chlorophenyl)methyl]-N-ethyl-9-methoxy-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V021-8107 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-N-ethyl-9-methoxy-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 413.95 |
| Molecular Formula: | C23 H28 Cl N3 O2 |
| Salt: | not_available |
| Smiles: | CCNC(C1Cc2ccc(cc2N2CCN(CC12)Cc1ccc(cc1)[Cl])OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8576 |
| logD: | 3.3631 |
| logSw: | -4.4678 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.938 |
| InChI Key: | XZKSEUOVYCDAFR-UHFFFAOYSA-N |