Bisbenzimidazole trihydrochloride

4-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenol;trihydrochloride

CAS: 23491-45-4

Molecular Formula	`C25H27Cl3N6O`
Molecular Weight	533.9 g/mol
Topological Polar Surface Area	84.1 A2
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	532.13116
Heavy Atoms	35
Complexity	634.0

Chemical Identifiers

CAS Number	23491-45-4
SMILES	`CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)O.Cl.Cl.Cl`
InChIKey	`SMNPLAKEGAEPJD-UHFFFAOYSA-N`

📖 Product Overview

Bisbenzimidazole trihydrochloride (CAS: 23491-45-4) is a chemical compound with molecular formula C25H27Cl3N6O and molecular weight 533.9 g/mol. Its IUPAC systematic name is 4-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenol;trihydrochloride. Topological Polar Surface Area 84.1 A2 Hydrogen Bond Donors 6 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 532.13116 Heavy Atoms 35 Complexity 634.0 InChI Key: SMNPLAKEGAEPJD-UHFFFAOYSA-N. SMILES: CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)O.Cl.Cl.Cl.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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