5-(4-ethylphenyl)-1-[(4-ethylphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione

Chemical Structure Depiction of
5-(4-ethylphenyl)-1-[(4-ethylphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Available: 114 mg
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mg
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Compound characteristics

Compound ID: C433-0647
Compound Name: 5-(4-ethylphenyl)-1-[(4-ethylphenyl)methyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Molecular Weight: 362.43
Molecular Formula: C21 H22 N4 O2
Smiles: CCc1ccc(CN2C3C(C(N(C3=O)c3ccc(CC)cc3)=O)N=N2)cc1
Stereo: MIXTURE OF STEREOISOMERS
logP: 3.5198
logD: 3.5196
logSw: -3.3838
Hydrogen bond acceptors count: 6
Polar surface area: 57.373
InChI Key: PQXFRVVRTHLNCB-UHFFFAOYSA-N
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