diethyl 3-methyl-5-{2-[(4-methyl-5-{[2-(trifluoromethyl)benzamido]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}thiophene-2,4-dicarboxylate

Chemical Structure Depiction of
diethyl 3-methyl-5-{2-[(4-methyl-5-{[2-(trifluoromethyl)benzamido]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}thiophene-2,4-dicarboxylate
Available: 289 mg
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mg
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Compound characteristics

Compound ID: K403-0783
Compound Name: diethyl 3-methyl-5-{2-[(4-methyl-5-{[2-(trifluoromethyl)benzamido]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}thiophene-2,4-dicarboxylate
Molecular Weight: 613.63
Molecular Formula: C25 H26 F3 N5 O6 S2
Smiles: CCOC(c1c(C)c(C(=O)OCC)sc1NC(CSc1nnc(CNC(c2ccccc2C(F)(F)F)=O)n1C)=O)=O
Stereo: ACHIRAL
logP: 3.2516
logD: 1.3771
logSw: -3.713
Hydrogen bond acceptors count: 13
Hydrogen bond donors count: 2
Polar surface area: 115.163
InChI Key: OWWJNKBOKHFRPX-UHFFFAOYSA-N
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