1-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-3-(2-methylphenoxy)propan-2-ol
Chemical Structure Depiction of
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-3-(2-methylphenoxy)propan-2-ol
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-3-(2-methylphenoxy)propan-2-ol
Compound characteristics
| Compound ID: | V028-4296 |
| Compound Name: | 1-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-3-(2-methylphenoxy)propan-2-ol |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C27 H31 N O6 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1OCC(CN(Cc1ccc(c(c1)OC)OC)Cc1ccc2c(c1)OCO2)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6792 |
| logD: | 3.0999 |
| logSw: | -4.496 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.26 |
| InChI Key: | IPSQHGBKZAVYJT-QFIPXVFZSA-N |