7-hydroxy-3,4-dimethyl-8-[(methyl{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}amino)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-hydroxy-3,4-dimethyl-8-[(methyl{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}amino)methyl]-2H-1-benzopyran-2-one
7-hydroxy-3,4-dimethyl-8-[(methyl{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}amino)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y043-6276 |
| Compound Name: | 7-hydroxy-3,4-dimethyl-8-[(methyl{[rel-(1R,9aS)-octahydro-2H-quinolizin-1-yl]methyl}amino)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 384.52 |
| Molecular Formula: | C23 H32 N2 O3 |
| Smiles: | CC1=C(C)c2ccc(c(CN(C)C[C@@H]3CCCN4CCCC[C@H]34)c2OC1=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0592 |
| logD: | 1.5269 |
| logSw: | -3.1029 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.587 |
| InChI Key: | HRDURUSTQFCTOI-XLIONFOSSA-N |