2-[[4-(2-methylsulfanylphenyl)piperazin-1-yl]methyl]-1H-thieno[3,4-d]imidazole

HCID 9997635
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Basic information

Standard SMILES
CSc1ccccc1N1CCN(Cc2nc3cscc3[nH]2)CC1
InChIKey
QHGPTAVIZKXCSQ-UHFFFAOYSA-N
Molecular formula
C17H20N4S2
Average molar mass
344.5 g/mol
Monoisotopic mass
344.112939

Names & identifiers

Preferred name
2-[[4-(2-methylsulfanylphenyl)piperazin-1-yl]methyl]-1H-thieno[3,4-d]imidazole
IUPAC
2-[[4-(2-methylsulfanylphenyl)piperazin-1-yl]methyl]-1H-thieno[3,4-d]imidazole

Names & synonyms

SCHEMBL4823304

Database identifiers

PubChem CID
9997635

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
88.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
23

Related reactions

1 records
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Compound notes

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