AC1Q3ALZ
4-[4-[3-(2-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one;dihydrochloride
Also Known As: Methyl-4-isopropylallophanimidat|N1-(3-(4'-Fluorobenzoyl)propyl)-N2-(3-(2'-chlorophenoxy)-2-hydroxypropyl)piperazine 2HCl|1-Butanone, 4-(4-(3-(2-chlorophenoxy)-2-hydroxypropyl)-1-piperazinyl)-1-(4-fluorophenyl)-, dihydrochloride|4-(4-(3-(2-Chlorophenoxy)-2-hydroxypropyl)-1-piperazinyl)-1-(4-fluorophenyl)-1-butanone 2HCl|4-{4-[3-(2-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl}-1-(4-fluorophenyl)butan-1-one dihydrochloride|4-[4-[3-(2-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one dihydrochloride|4-[4-[3-(2-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one,dihydrochloride|4-{4-[3-(2-Chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl}-1-(4-fluorophenyl)butan-1-one--hydrogen chloride (1/2)
| Molecular Formula | C23H30Cl3FN2O3 |
|---|---|
| Molecular Weight | 506.1306 g/mol |
| LogP | 4.3431 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 506.1306 |
| Monoisotopic Mass | 506.1306 |
| Heavy Atoms | 32 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 5352-99-8 |
|---|---|
| SMILES | C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)CC(COC3=CC=CC=C3Cl)O.Cl.Cl |
| InChIKey | HYQLUVBETRFFMB-UHFFFAOYSA-N |
Product Overview
AC1Q3ALZ (CAS 5352-99-8), with molecular formula C23H30Cl3FN2O3 and molecular weight 506.1306 g/mol. IUPAC: 4-[4-[3-(2-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one;dihydrochloride.