N-(5-butyl-2-pyridinylmethyl)-N'-(1H-benzimidazol-2-ylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamine

HCID 22018809
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Basic information

Standard SMILES
CCCCc1ccc(CNCc2ccc(CN(Cc3nc4ccccc4[nH]3)C3CCCc4cccnc43)cc2)nc1
InChIKey
LBOUISMFJMGZLU-UHFFFAOYSA-N
Molecular formula
C35H40N6
Average molar mass
544.7 g/mol

Names & identifiers

Preferred name
N-(5-butyl-2-pyridinylmethyl)-N'-(1H-benzimidazol-2-ylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamine
IUPAC
N-(1H-benzimidazol-2-ylmethyl)-N-[[4-[[(5-butyl-2-pyridinyl)methylamino]methyl]phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine

Names & synonyms

SCHEMBL4064223LBOUISMFJMGZLU-UHFFFAOYSA-NN-(5-butyl-2-pyridinylmethyl)-N'-(1H-benzimidazol-2-ylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamine

Database identifiers

PubChem CID
22018809

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
69.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
12
Heavy atoms
41

Related reactions

1 records
New reaction record

Linked notes

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N-(5-butyl-2-pyridinylmethyl)-N'-(1H-benzimidazol-2-ylmethyl)-N'-(5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamine (HCID 22018809)｜Huagongshe