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1-(2-Ethoxyethyl)-2-(4-methylpiperazin-1-yl)benzimidazole

HCID 3071004
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
87233-65-6
Standard SMILES
CCOCCn1c(N2CCN(C)CC2)nc2ccccc21
InChIKey
GARASDOODWWZMF-UHFFFAOYSA-N
Molecular formula
C16H24N4O
Average molar mass
288.39 g/mol
Monoisotopic mass
288.1950114

Names & identifiers

Preferred name
1-(2-Ethoxyethyl)-2-(4-methylpiperazin-1-yl)benzimidazole
IUPAC
1-(2-ethoxyethyl)-2-(4-methylpiperazin-1-yl)benzimidazole

Names & synonyms

CHEMBL4303381-(2-ethoxyethyl)-2-(4-methylpiperazin-1-yl)benzimidazole87233-65-6SCHEMBL10922792DTXSID60388937GARASDOODWWZMF-UHFFFAOYSA-N1-[2-(ethoxy)ethyl]-2-(4-methyl-1-piperazinyl)benzimidazole1-(2-ethoxyethyl)-2-(4-methyl-1-piperazinyl)-1H-benzimidazoleBDBM50019607AN-890/145890461-(2-Ethoxy-ethyl)-2-(4-methyl-piperazin-1-yl)-1H-benzoimidazole1-(2-Ethoxyethyl)-2-(4-methylpiperazin-1-yl)-1H-1,3-benzimidazole

Database identifiers

CAS
87233-65-6
PubChem CID
3071004
DTXSID
DTXSID60388937
ChEMBL
CHEMBL430338
Nikkaji
J557.604K

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
33.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
319

Related reactions

1 records
New reaction record
HRID 1388164 reaction equation
HRID 1388164As productuspto-grants-1984_02

Compound notes

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