4-methyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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4-methyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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CAS No:
730947-87-2
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Formula:
C13H14N4O3S
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Chemical Name:
4-methyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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Synonyms:
4-methyl-3-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoic acid;730947-87-2;4-methyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic Acid;ZINC3378568;AKOS033712415;CCG-321109;MCULE-8064232013;EN300-08516;SR-01000046886;SR-01000046886-1;Z19813680
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CAS No:
4-methyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid Basic Attributes
306.34 g/mol
306.07866149 g/mol
Computed Properties
Molecular Weight:306.34
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:306.07866149
Monoisotopic Mass:306.07866149
Topological Polar Surface Area:122
Heavy Atom Count:21
Complexity:396
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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