AC1MIJJR
4-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-(4-methylphenyl)ethyl]benzene-1,2-diol;dihydrobromide
Also Known As: 1,2-Benzenediol, 4-(2-(4-(2-hydroxyethyl)-1-piperazinyl)-2-(4-methylphenyl)ethyl)-, dihydrobromide|1-(2-(3,4-Dihydroxyphenyl)-1-(4-tolyl)ethyl)-4-(2-hydroxyethyl)piperazine hydrobromide|4-(2-(4-(2-Hydroxyethyl)-1-piperazinyl)-2-(4-methylphenyl)ethyl)-1,2-benzenediol 2HBr|4-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-(4-methylphenyl)ethyl]benzene-1,2-diol dihydrobromide|4-{2-[4-(2-Hydroxyethyl)piperazin-1-yl]-2-(4-methylphenyl)ethyl}benzene-1,2-diol--hydrogen bromide (1/2)
| Molecular Formula | C21H30Br2N2O3 |
|---|---|
| Molecular Weight | 516.0623 g/mol |
| LogP | 3.45572 |
| Topological Polar Surface Area | 67.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 516.0623 |
| Monoisotopic Mass | 518.06024 |
| Heavy Atoms | 28 |
| Complexity | 720.0907 |
Chemical Identifiers
| CAS Number | 87203-85-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(CC2=CC(=C(C=C2)O)O)N3CCN(CC3)CCO.Br.Br |
Product Overview
AC1MIJJR (CAS 87203-85-8), with molecular formula C21H30Br2N2O3 and molecular weight 516.0623 g/mol. IUPAC: 4-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-(4-methylphenyl)ethyl]benzene-1,2-diol;dihydrobromide.