1-(2H-1,3-benzodioxol-5-yl)-N-{[5-(4-bromophenyl)furan-2-yl]methyl}methanamine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-N-{[5-(4-bromophenyl)furan-2-yl]methyl}methanamine--hydrogen chloride (1/1)
1-(2H-1,3-benzodioxol-5-yl)-N-{[5-(4-bromophenyl)furan-2-yl]methyl}methanamine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D665-0425 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-N-{[5-(4-bromophenyl)furan-2-yl]methyl}methanamine--hydrogen chloride (1/1) |
| Molecular Weight: | 422.7 |
| Molecular Formula: | C19 H16 Br N O3 |
| Salt: | HCl |
| Smiles: | [H]N(Cc1ccc2c(c1)OCO2)Cc1ccc(c2ccc(cc2)[Br])o1 |
| Stereo: | ACHIRAL |
| logP: | 4.8805 |
| logD: | 3.4416 |
| logSw: | -5.016 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.689 |
| InChI Key: | OTIPVTZMCSYXED-UHFFFAOYSA-N |