N-(4-acetylphenyl)-2-({4-benzyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Chemical Structure Depiction of
N-(4-acetylphenyl)-2-({4-benzyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Available: 183 mg
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mg
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Compound characteristics

Compound ID: C592-2644
Compound Name: N-(4-acetylphenyl)-2-({4-benzyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Molecular Weight: 459.57
Molecular Formula: C25 H25 N5 O2 S
Smiles: CC(c1ccc(cc1)NC(CSc1nnc(Cc2cccn2C)n1Cc1ccccc1)=O)=O
Stereo: ACHIRAL
logP: 3.5836
logD: 3.5834
logSw: -3.8199
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 64.819
InChI Key: DCYYLSNOMYVBCB-UHFFFAOYSA-N
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