1-(4-methylphenyl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one

Chemical Structure Depiction of
1-(4-methylphenyl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Available: 2 mg
Amount:
mg
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Compound characteristics

Compound ID: F235-1956
Compound Name: 1-(4-methylphenyl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Molecular Weight: 309.39
Molecular Formula: C17 H15 N3 O S
Smiles: Cc1ccc(cc1)C(CSc1nnc(c2ccccc2)[nH]1)=O
Stereo: ACHIRAL
logP: 3.3063
logD: 2.0966
logSw: -3.6213
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 45.721
InChI Key: IPBGAVIKMXQJCH-UHFFFAOYSA-N
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