2-(2H-1,3-benzodioxol-5-yl)-N-[(4-ethoxyphenyl)methyl]-N-[(pyridin-3-yl)methyl]ethan-1-amine--oxalic acid (1/1)
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[(4-ethoxyphenyl)methyl]-N-[(pyridin-3-yl)methyl]ethan-1-amine--oxalic acid (1/1)
2-(2H-1,3-benzodioxol-5-yl)-N-[(4-ethoxyphenyl)methyl]-N-[(pyridin-3-yl)methyl]ethan-1-amine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4964-5210 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[(4-ethoxyphenyl)methyl]-N-[(pyridin-3-yl)methyl]ethan-1-amine--oxalic acid (1/1) |
| Molecular Weight: | 480.52 |
| Molecular Formula: | C24 H26 N2 O3 |
| Salt: | HOOCCOOH |
| Smiles: | CCOc1ccc(CN(CCc2ccc3c(c2)OCO3)Cc2cccnc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.969 |
| logD: | 3.9513 |
| logSw: | -3.6586 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.414 |
| InChI Key: | ZMLYKCPPESQJOJ-UHFFFAOYSA-N |