2-[({5-[(4-tert-butylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-7,8-dimethylquinolin-4(1H)-one

Chemical Structure Depiction of
2-[({5-[(4-tert-butylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-7,8-dimethylquinolin-4(1H)-one
Available: 77 mg
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mg
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Compound characteristics

Compound ID: G751-5658
Compound Name: 2-[({5-[(4-tert-butylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-7,8-dimethylquinolin-4(1H)-one
Molecular Weight: 462.61
Molecular Formula: C26 H30 N4 O2 S
Smiles: Cc1ccc2C(C=C(CSc3nnc(COc4ccc(cc4)C(C)(C)C)n3C)Nc2c1C)=O
Stereo: ACHIRAL
logP: 5.5772
logD: 5.572
logSw: -5.383
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 56.069
InChI Key: XOZIPKJYXULGAF-UHFFFAOYSA-N
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