3-({[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile

Chemical Structure Depiction of
3-({[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Available: 2 mg
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mg
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Compound characteristics

Compound ID: V030-6026
Compound Name: 3-({[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Molecular Weight: 428.51
Molecular Formula: C24 H20 N4 O2 S
Salt: not_available
Smiles: COc1ccc(cc1OC)c1nnc(n1c1ccccc1)SCc1cccc(C#N)c1
Stereo: ACHIRAL
logP: 4.465
logD: 4.465
logSw: -4.4931
Hydrogen bond acceptors count: 6
Polar surface area: 57.03
InChI Key: DDMQVOJODFMUKX-UHFFFAOYSA-N
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