5,6-methylenedioxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole

HCID 21295863
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Basic information

Standard SMILES
COc1c(C)cnc(CS(=O)c2nc3cc4c(cc3[nH]2)OCO4)c1C
InChIKey
GUKDXXHEKIERHZ-UHFFFAOYSA-N
Molecular formula
C17H17N3O4S
Average molar mass
359.4 g/mol

Names & identifiers

Preferred name
5,6-methylenedioxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole
IUPAC
6-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-5H-[1,3]dioxolo[4,5-f]benzimidazole

Names & synonyms

SCHEMBL9793531GUKDXXHEKIERHZ-UHFFFAOYSA-N5,6-methylenedioxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole

Database identifiers

PubChem CID
21295863

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
106 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
25

Related reactions

3 records
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Compound notes

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