N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[4-(2-methoxyphenyl)-2,2-dimethyloxan-4-yl]ethan-1-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[4-(2-methoxyphenyl)-2,2-dimethyloxan-4-yl]ethan-1-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[4-(2-methoxyphenyl)-2,2-dimethyloxan-4-yl]ethan-1-amine
Compound characteristics
| Compound ID: | D442-0097 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[4-(2-methoxyphenyl)-2,2-dimethyloxan-4-yl]ethan-1-amine |
| Molecular Weight: | 397.51 |
| Molecular Formula: | C24 H31 N O4 |
| Smiles: | CC1(C)CC(CCNCc2ccc3c(c2)OCO3)(CCO1)c1ccccc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9988 |
| logD: | 1.45 |
| logSw: | -4.3545 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.711 |
| InChI Key: | AGIYXPDLWJRDFS-DEOSSOPVSA-N |