RefChem:1057830 structure

RefChem:1057830

bis((E)-but-2-enedioic acid);2-(4-methyl-1,4-diazepan-1-yl)-1-(2-prop-2-enoxyethyl)benzimidazole

Also Known As: 1-(2-(Allyloxy)ethyl)-2-(4-methyl-1-homopiperazinyl)benzimidazole difumarate|1H-Benzimidazole, 2-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-1-(2-(2-propenyloxy)ethyl)-, (E)-2-butenedioate (1:2)|1-[2-(allyloxy)ethyl]-2-(4-methyl-1-homopiperazinyl)benzimidazole difumarate|(E)-but-2-enedioic acid; 2-(4-methyl-1,4-diazepan-1-yl)-1-(2-prop-2-enoxyethyl)benzimidazole

CAS: 87233-68-9
Molecular Formula C26H34N4O9
Molecular Weight 546.2326 g/mol
LogP 1.8044
Topological Polar Surface Area 182.73 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 8
Rotatable Bonds 10
Exact Mass 546.2326
Monoisotopic Mass 546.2326
Heavy Atoms 39
Complexity 1107.3849

Chemical Identifiers

CAS Number 87233-68-9
SMILES CN1CCN(CCC1)C2=NC3=CC=CC=C3N2CCOCC=C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

Product Overview

RefChem:1057830 (CAS 87233-68-9), with molecular formula C26H34N4O9 and molecular weight 546.2326 g/mol. IUPAC: bis((E)-but-2-enedioic acid);2-(4-methyl-1,4-diazepan-1-yl)-1-(2-prop-2-enoxyethyl)benzimidazole.

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