N-benzyl-3-(3-methoxyphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-benzyl-3-(3-methoxyphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-benzyl-3-(3-methoxyphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V018-8684 |
| Compound Name: | N-benzyl-3-(3-methoxyphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 427.55 |
| Molecular Formula: | C27 H29 N3 O2 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)N1CCN2C(C1)C(Cc1ccccc12)C(NCc1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3752 |
| logD: | 4.3748 |
| logSw: | -4.2849 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.761 |
| InChI Key: | DUNYZZHGZWDJBS-UHFFFAOYSA-N |