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7-Chloro-1-(3-methoxypropyl)-2-piperidin-3-ylbenzimidazole

HCID 66786366
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COCCCn1c(C2CCCNC2)nc2cccc(Cl)c21
InChIKey
XGZKJAYKPBIUKF-UHFFFAOYSA-N
Molecular formula
C16H22ClN3O
Average molar mass
307.82 g/mol

Names & identifiers

Preferred name
7-Chloro-1-(3-methoxypropyl)-2-piperidin-3-ylbenzimidazole
IUPAC
7-chloro-1-(3-methoxypropyl)-2-piperidin-3-ylbenzimidazole

Names & synonyms

SCHEMBL742021

Database identifiers

PubChem CID
66786366

Properties

Computed structural propertiesFilling in

XLogP
2.4
Topological polar surface area
39.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
331

Related reactions

2 records
New reaction record
HRID 679725 reaction equation
HRID 679725As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 2124014 reaction equation
HRID 2124014As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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