N-(3-Methoxypropyl)-6-[[1-(4-methylphenyl)-2-benzylmercapto-1H-benzimidazol-6-yl]oxy]Hexanamide

HCID 69438142
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Basic information

Standard SMILES
COCCCNC(=O)CCCCCOc1ccc2nc(SCc3ccccc3)n(-c3ccc(C)cc3)c2c1
InChIKey
MBVNYTGRTMGWFD-UHFFFAOYSA-N
Molecular formula
C31H37N3O3S
Average molar mass
531.7 g/mol

Names & identifiers

Preferred name
N-(3-Methoxypropyl)-6-[[1-(4-methylphenyl)-2-benzylmercapto-1H-benzimidazol-6-yl]oxy]Hexanamide
IUPAC
6-[2-benzylsulfanyl-3-(4-methylphenyl)benzimidazol-5-yl]oxy-N-(3-methoxypropyl)hexanamide

Names & synonyms

SCHEMBL5430129MBVNYTGRTMGWFD-UHFFFAOYSA-NN-(3-Methoxypropyl)-6-[[1-(4-methylphenyl)-2-benzylmercapto-1H-benzimidazol-6-yl]oxy]Hexanamide

Database identifiers

PubChem CID
69438142

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
90.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
15
Heavy atoms
38

Related reactions

3 records
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Compound notes

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