2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Chemical Structure Depiction of
2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Available: 96 mg
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mg
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Compound characteristics

Compound ID: 5629-2309
Compound Name: 2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Molecular Weight: 549.61
Molecular Formula: C30 H23 N5 O4 S
Smiles: [H]C(=C1/C(n2c(nc(C3COc4ccccc4O3)n2)S1)=O)\c1cn(c2ccccc2)nc1c1ccc(c(C)c1)OC
Stereo: RACEMIC MIXTURE
logP: 5.8068
logD: 5.8068
logSw: -5.5646
Hydrogen bond acceptors count: 9
Polar surface area: 74.896
InChI Key: XZYFCTGJBHDMFW-VWLOTQADSA-N
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