1-(2H-1,3-benzodioxol-5-yl)-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]methanamine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]methanamine--hydrogen chloride (1/1)
1-(2H-1,3-benzodioxol-5-yl)-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]methanamine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8019-0342 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]methanamine--hydrogen chloride (1/1) |
| Molecular Weight: | 416.7 |
| Molecular Formula: | C17 H18 Br N O4 |
| Salt: | HCl |
| Smiles: | [H]N(Cc1ccc2c(c1)OCO2)Cc1cc(c(c(c1)[Br])OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5099 |
| logD: | -0.207 |
| logSw: | -3.5479 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.467 |
| InChI Key: | MQSJMKGUPPMMGK-UHFFFAOYSA-N |