1-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-3,3-dimethyl-3,4-dihydroisoquinoline

Chemical Structure Depiction of
1-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-3,3-dimethyl-3,4-dihydroisoquinoline
Available: 5 mg
Amount:
mg
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Compound characteristics

Compound ID: 8013-5732
Compound Name: 1-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-3,3-dimethyl-3,4-dihydroisoquinoline
Molecular Weight: 321.44
Molecular Formula: C19 H19 N3 S
Smiles: CC1(C)Cc2ccccc2C(CSc2nc3ccccc3[nH]2)=N1
Stereo: ACHIRAL
logP: 4.0056
logD: 3.8959
logSw: -4.3577
Hydrogen bond acceptors count: 3
Hydrogen bond donors count: 1
Polar surface area: 25.7558
InChI Key: PNSCAIWYNDYTJT-UHFFFAOYSA-N
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