N-(3-methoxyphenyl)-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-(3-methoxyphenyl)-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-(3-methoxyphenyl)-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V014-5873 |
| Compound Name: | N-(3-methoxyphenyl)-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C26 H27 N3 O2 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)NC(C1Cc2ccccc2N2CCN(CC12)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8576 |
| logD: | 4.8567 |
| logSw: | -4.4645 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.438 |
| InChI Key: | MZAAWJNSNBZDCC-UHFFFAOYSA-N |