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

Chemical Structure Depiction of
N-{[5-({2-[5-(2,3-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-3-fluorobenzamide
Available: 386 mg
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mg
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Compound characteristics

Compound ID: A0070273
Compound Name: N-{[5-({2-[5-(2,3-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-3-fluorobenzamide
Molecular Weight: 656.76
Molecular Formula: C33 H29 F N6 O4 S2
Smiles: COc1cccc(C2CC(c3cccs3)=NN2C(CSc2nnc(CNC(c3cccc(c3)F)=O)n2c2ccccc2)=O)c1OC
Stereo: RACEMIC MIXTURE
logP: 5.3744
logD: 5.3743
logSw: -5.4156
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 1
Polar surface area: 93.36
InChI Key: MJQBIGBLAHHXLM-AREMUKBSSA-N
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