3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxylic acid
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3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxylic acid
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CAS No:
565210-75-5
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Formula:
C12H9N3O3S
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Chemical Name:
3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxylic acid
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Synonyms:
3-[(4H-1,2,4-triazol-3-ylsulfanyl)methyl]-1-benzofuran-2-carboxylic acid;565210-75-5;ZINC3345029;3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxylic acid;AKOS000117146;AKOS008966975;MCULE-5691098856;NE53502;EN300-06604;SR-01000045357;SR-01000045357-1;Z56931813;3-(4H-[1,2,4]triazol-3-ylsulfanylmethyl)-benzofuran-2-carboxylic acid, AldrichCPR
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CAS No:
3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxylic acid Basic Attributes
275.29 g/mol
275.03646233 g/mol
Computed Properties
Molecular Weight:275.29
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:275.03646233
Monoisotopic Mass:275.03646233
Topological Polar Surface Area:117
Heavy Atom Count:19
Complexity:344
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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