2-(2H-1,3-benzodioxol-5-yl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethan-1-amine--oxalic acid (1/1)
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethan-1-amine--oxalic acid (1/1)
2-(2H-1,3-benzodioxol-5-yl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethan-1-amine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4964-4942 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethan-1-amine--oxalic acid (1/1) |
| Molecular Weight: | 435.43 |
| Molecular Formula: | C19 H23 N O5 |
| Salt: | HOOCCOOH |
| Smiles: | COc1ccc(CNCCc2ccc3c(c2)OCO3)c(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5312 |
| logD: | -0.0645 |
| logSw: | -2.8712 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.026 |
| InChI Key: | DYTYXLRBZVKVEB-UHFFFAOYSA-N |