9-methoxy-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
9-methoxy-N-(3-methylbutyl)-3-(4-methylphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
9-methoxy-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: | V003-2835 |
| Compound Name: | 9-methoxy-N-(3-methylbutyl)-3-(4-methylphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 421.58 |
| Molecular Formula: | C26 H35 N3 O2 |
| Smiles: | CC(C)CCNC(C1Cc2ccc(cc2N2CCN(CC12)c1ccc(C)cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4229 |
| logD: | 5.4207 |
| logSw: | -5.2671 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.874 |
| InChI Key: | WTPYZKJTQASZFG-UHFFFAOYSA-N |