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2-[5-(2,6-dimethylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-(2-methylphenyl)acetamide

Chemical Structure Depiction of
2-[5-(2,6-dimethylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-(2-methylphenyl)acetamide
Available: 5 mg
Amount:
mg
Format:
$83.09
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Compound characteristics

Compound ID: C433-0228
Compound Name: 2-[5-(2,6-dimethylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-(2-methylphenyl)acetamide
Molecular Weight: 391.43
Molecular Formula: C21 H21 N5 O3
Smiles: Cc1ccccc1NC(CN1C2C(C(N(C2=O)c2c(C)cccc2C)=O)N=N1)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 1.8268
logD: 1.8267
logSw: -2.3463
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 79.222
InChI Key: XYMLIGXWGQOEGG-UHFFFAOYSA-N
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