N-{[5-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-4-methoxybenzamide

Chemical Structure Depiction of
N-{[5-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-4-methoxybenzamide
Available: 417 mg
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mg
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Compound characteristics

Compound ID: A0070498
Compound Name: N-{[5-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-4-methoxybenzamide
Molecular Weight: 630.72
Molecular Formula: C32 H34 N6 O6 S
Smiles: Cn1c(CNC(c2ccc(cc2)OC)=O)nnc1SCC(N1C(CC(c2ccc(cc2)OC)=N1)c1cccc(c1OC)OC)=O
Stereo: RACEMIC MIXTURE
logP: 3.9284
logD: 3.9284
logSw: -4.1331
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 1
Polar surface area: 107.767
InChI Key: ZFPMECZNVWDKEK-SANMLTNESA-N
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