2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]benzoic acid
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![2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/56d836b057b4443f83097671ce8496d2.png "2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]benzoic acid")
2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]benzoic acid
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CAS No:
743445-05-8
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Formula:
C15H14N4O2S
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Chemical Name:
2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]benzoic acid
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Synonyms:
2-{[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio]methyl}benzoic acid;743445-05-8;2-[({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)methyl]benzoic acid;2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]benzoic acid;2-(((5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio)methyl)benzoic acid;MLS001174504;CHEMBL1721861;HMS2873I24;ZINC2650287;AKOS027427128;MCULE-9596496644;NE31238;SMR000588482;EN300-08813;J-507673;Z55928882
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CAS No:
2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]benzoic acid Basic Attributes
314.4 g/mol
314.08374688 g/mol
Computed Properties
Molecular Weight:314.4
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:314.08374688
Monoisotopic Mass:314.08374688
Topological Polar Surface Area:106
Heavy Atom Count:22
Complexity:411
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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