N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethan-1-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethan-1-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethan-1-amine
Compound characteristics
| Compound ID: | D442-0265 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethan-1-amine |
| Molecular Weight: | 361.52 |
| Molecular Formula: | C22 H35 N O3 |
| Smiles: | CC(C)CCC1(CCNCc2ccc3c(c2)OCO3)CCOC(C)(C)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5443 |
| logD: | 2.0603 |
| logSw: | -4.3513 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.352 |
| InChI Key: | HAJXKEQGBKSSCO-QFIPXVFZSA-N |