N-(3-methylbutyl)-3-(pyrimidin-2-yl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-3-(pyrimidin-2-yl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-(3-methylbutyl)-3-(pyrimidin-2-yl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V018-8690 |
| Compound Name: | N-(3-methylbutyl)-3-(pyrimidin-2-yl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 379.5 |
| Molecular Formula: | C22 H29 N5 O |
| Smiles: | CC(C)CCNC(C1Cc2ccccc2N2CCN(CC12)c1ncccn1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5763 |
| logD: | 3.5763 |
| logSw: | -3.5447 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.692 |
| InChI Key: | HVQRYSYPTMFHIG-UHFFFAOYSA-N |