AC1OBJIY
4-[3-[(3,4-dichlorophenyl)methyl]-1H-benzimidazol-3-ium-2-yl]-1,2,5-oxadiazol-3-amine
Also Known As: 4-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-1-ium-2-ylidene]-1,2,5-oxadiazol-3-amine|4-[1-[(3,4-dichlorophenyl)methyl]benzoimidazol-2-ylidene]-1,2,5-oxadiazol-3-amine|4-[3-[(3,4-dichlorophenyl)methyl]-1H-benzimidazol-3-ium-2-yl]-1,2,5-oxadiazol-3-amine|2-(4-Amino-1,2,5-oxadiazol-3(2H)-ylidene)-1-[(3,4-dichlorophenyl)methyl]-2H-1,3-benzimidazol-1-ium
| Molecular Formula | C16H12Cl2N5O+ |
|---|---|
| Molecular Weight | 360.0419 g/mol |
| LogP | 3.4427 |
| Topological Polar Surface Area | 84.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 360.0419 |
| Monoisotopic Mass | 360.0419 |
| Heavy Atoms | 24 |
| Complexity | 1040.0636 |
Chemical Identifiers
| CAS Number | 6752-98-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=[N+]2CC3=CC(=C(C=C3)Cl)Cl)C4=NON=C4N |
Product Overview
AC1OBJIY (CAS 6752-98-3), with molecular formula C16H12Cl2N5O+ and molecular weight 360.0419 g/mol. IUPAC: 4-[3-[(3,4-dichlorophenyl)methyl]-1H-benzimidazol-3-ium-2-yl]-1,2,5-oxadiazol-3-amine.
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