3-[(4-fluorophenyl)methyl]-N-(3-methoxyphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-[(4-fluorophenyl)methyl]-N-(3-methoxyphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-[(4-fluorophenyl)methyl]-N-(3-methoxyphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V006-3456 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-N-(3-methoxyphenyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C27 H28 F N3 O2 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)NC(C1Cc2ccccc2N2CCN(CC12)Cc1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5385 |
| logD: | 3.975 |
| logSw: | -4.1635 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.718 |
| InChI Key: | HKHRVFDJYYDLOV-UHFFFAOYSA-N |