2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethan-1-one

Chemical Structure Depiction of
2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethan-1-one
Available: 15 mg
Amount:
mg
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Compound characteristics

Compound ID: 5756-1168
Compound Name: 2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethan-1-one
Molecular Weight: 325.39
Molecular Formula: C16 H15 N5 O S
Smiles: Cc1ccc(cc1)C(CSc1nnc(c2cccnc2)n1N)=O
Stereo: ACHIRAL
logP: 1.6244
logD: 1.6176
logSw: -1.5431
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 64.904
InChI Key: VEHNLGRFTVFWCY-UHFFFAOYSA-N
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