7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-hydroxypropoxy)-3,4,8-trimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-hydroxypropoxy)-3,4,8-trimethyl-2H-1-benzopyran-2-one
7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-hydroxypropoxy)-3,4,8-trimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-4513 |
| Compound Name: | 7-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-hydroxypropoxy)-3,4,8-trimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 441.52 |
| Molecular Formula: | C25 H31 N O6 |
| Smiles: | CC1=C(C)c2ccc(c(C)c2OC1=O)OCC(CNCCc1ccc(c(c1)OC)OC)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.06 |
| logD: | 1.9303 |
| logSw: | -3.2971 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.918 |
| InChI Key: | DUOUUCVBZFYPRY-IBGZPJMESA-N |