(8-nitro-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-yl)(thiomorpholin-4-yl)methanone
Chemical Structure Depiction of
(8-nitro-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-yl)(thiomorpholin-4-yl)methanone
(8-nitro-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-yl)(thiomorpholin-4-yl)methanone
Compound characteristics
| Compound ID: | V008-4573 |
| Compound Name: | (8-nitro-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-yl)(thiomorpholin-4-yl)methanone |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Salt: | not_available |
| Smiles: | C1C(C2CN(CCN2c2ccc(cc12)[N+]([O-])=O)c1ccccc1)C(N1CCSCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3938 |
| logD: | 3.3934 |
| logSw: | -3.7935 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.833 |
| InChI Key: | FRCHUXRQHQSRHN-UHFFFAOYSA-N |