1-{[(2H-1,3-benzodioxol-5-yl)methyl][(2,5-dimethylphenyl)methyl]amino}-3-(2-methylphenoxy)propan-2-ol
Chemical Structure Depiction of
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(2,5-dimethylphenyl)methyl]amino}-3-(2-methylphenoxy)propan-2-ol
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(2,5-dimethylphenyl)methyl]amino}-3-(2-methylphenoxy)propan-2-ol
Compound characteristics
| Compound ID: | V006-0774 |
| Compound Name: | 1-{[(2H-1,3-benzodioxol-5-yl)methyl][(2,5-dimethylphenyl)methyl]amino}-3-(2-methylphenoxy)propan-2-ol |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C27 H31 N O4 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(CN(CC(COc2ccccc2C)O)Cc2ccc3c(c2)OCO3)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3063 |
| logD: | 5.7041 |
| logSw: | -5.5704 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.999 |
| InChI Key: | YBFRRKLLNPGKMD-DEOSSOPVSA-N |