1-({(E)-[9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-ylidene]amino}oxy)ethan-1-one
Chemical Structure Depiction of
1-({(E)-[9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-ylidene]amino}oxy)ethan-1-one
1-({(E)-[9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-ylidene]amino}oxy)ethan-1-one
Compound characteristics
| Compound ID: | 8015-3582 |
| Compound Name: | 1-({(E)-[9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-ylidene]amino}oxy)ethan-1-one |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C21 H30 N2 O4 |
| Smiles: | CC(C)CC1CN2CCc3cc(c(cc3C2C\C1=N/OC(C)=O)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8477 |
| logD: | 2.7773 |
| logSw: | -2.9896 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.208 |
| InChI Key: | HAPOKUSVNOKHRF-UHFFFAOYSA-N |