5-Hydroxydomperidone
3-[3-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propyl]-6-hydroxy-1H-benzimidazol-2-one
Also Known As: 5-Hydroxydomperidone|Hydroxydomperidone (M3)|Domperidone metabolite M3|J2.478.018J|2H-Benzimidazol-2-one, 5-chloro-1-(1-(3-(2,3-dihydro-5-hydroxy-2-oxo-1H-benzimidazol-1-yl)propyl)-4-piperidinyl)-1,3-dihydro-|1-[3-[4-(5-Chloro-2,3-dihydro-2-oxo-1H-benzoimidazole-1-yl)-1-piperidinyl]propyl]-5-hydroxy-1,3-dihydro-2H-benzoimidazole-2-one|1-{3-[4-(5-Chloro-2-oxo-2,3-dihydro-1H-1,3-benzimidazol-1-yl)piperidin-1-yl]propyl}-5-hydroxy-1,3-dihydro-2H-1,3-benzimidazol-2-one|2H-Benzimidazol-2-one, 5-chloro-1-[1-[3-(2,3-dihydro-5-hydroxy-2-oxo-1H-benzimidazol-1-yl)propyl]-4-piperidinyl]-1,3-dihydro-|3-[3-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propyl]-6-hydroxy-1H-benzimidazol-2-one|5-Chloro-1-[1-[3-(2,3-dihydro-5-hydroxy-2-oxo-1H-benzimidazol-1-yl)propyl]-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one|5-chloro-1-{1-[3-(5-hydroxy-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)propyl]piperidin-4-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one
| Molecular Formula | C22H24ClN5O3 |
|---|---|
| Molecular Weight | 441.15677 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 88.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.15677 |
| Monoisotopic Mass | 441.15677 |
| Heavy Atoms | 31 |
| Complexity | 688.0 |
Chemical Identifiers
| CAS Number | 82294-72-2 |
|---|---|
| SMILES | C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)CCCN4C5=C(C=C(C=C5)O)NC4=O |
| InChIKey | SWKZXSSZKVNAJG-UHFFFAOYSA-N |
Product Overview
5-Hydroxydomperidone (CAS 82294-72-2), with molecular formula C22H24ClN5O3 and molecular weight 441.15677 g/mol. IUPAC: 3-[3-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propyl]-6-hydroxy-1H-benzimidazol-2-one.
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