methyl 4-[[2-[[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
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methyl 4-[[2-[[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
structure -
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CAS No:
848990-89-6
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Formula:
C27H26N4O4S
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Chemical Name:
methyl 4-[[2-[[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
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Synonyms:
ZINC2446795;STK573276;AKOS005498136;MCULE-2245624515;ST50413948;848990-89-6;methyl 4-[({[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate;methyl 4-{2-[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-1,2,4-triazol-3-ylthio]acet ylamino}benzoate
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CAS No:
methyl 4-[[2-[[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate Basic Attributes
502.6 g/mol
502.16747650 g/mol
Computed Properties
Molecular Weight:502.6
XLogP3:5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:502.16747650
Monoisotopic Mass:502.16747650
Topological Polar Surface Area:121
Heavy Atom Count:36
Complexity:712
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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