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

Chemical Structure Depiction of
diethyl 3-methyl-5-[2-({5-[(3-methylbenzamido)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate
Available: 365 mg
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mg
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Compound characteristics

Compound ID: K403-0280
Compound Name: diethyl 3-methyl-5-[2-({5-[(3-methylbenzamido)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate
Molecular Weight: 635.76
Molecular Formula: C31 H33 N5 O6 S2
Smiles: CCOC(c1c(C)c(C(=O)OCC)sc1NC(CSc1nnc(CNC(c2cccc(C)c2)=O)n1c1cccc(C)c1)=O)=O
Stereo: ACHIRAL
logP: 4.9924
logD: 3.2084
logSw: -4.7132
Hydrogen bond acceptors count: 13
Hydrogen bond donors count: 2
Polar surface area: 114.825
InChI Key: WQFCOCXVLZSRNG-UHFFFAOYSA-N
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