N-(3-methylbutyl)-3-(4-methylphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-3-(4-methylphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-(3-methylbutyl)-3-(4-methylphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V008-8858 |
| Compound Name: | N-(3-methylbutyl)-3-(4-methylphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 391.56 |
| Molecular Formula: | C25 H33 N3 O |
| Salt: | not_available |
| Smiles: | CC(C)CCNC(C1Cc2ccccc2N2CCN(CC12)c1ccc(C)cc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0786 |
| logD: | 5.0765 |
| logSw: | -4.7229 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.3298 |
| InChI Key: | XITXBHBAXQAPAK-UHFFFAOYSA-N |