3-[2-(4-chlorophenyl)-2-oxoethylidene]-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)-2-oxoethylidene]-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one
3-[2-(4-chlorophenyl)-2-oxoethylidene]-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one
Compound characteristics
| Compound ID: | 8012-3445 |
| Compound Name: | 3-[2-(4-chlorophenyl)-2-oxoethylidene]-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one |
| Molecular Weight: | 352.82 |
| Molecular Formula: | C20 H17 Cl N2 O2 |
| Smiles: | C1CN2C(CNC(=C\C(c3ccc(cc3)[Cl])=O)\C2=O)c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7829 |
| logD: | 3.7818 |
| logSw: | -4.5106 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.683 |
| InChI Key: | ARESULWAIJQSSD-GOSISDBHSA-N |