2-[2-(4-carboxyanilino)-2-oxoethyl]sulfanylbenzoic acid
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![2-[2-(4-carboxyanilino)-2-oxoethyl]sulfanylbenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/357093fef4db4fb9a01711915042fba8.png "2-[2-(4-carboxyanilino)-2-oxoethyl]sulfanylbenzoic acid")
2-[2-(4-carboxyanilino)-2-oxoethyl]sulfanylbenzoic acid
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CAS No:
884803-01-4
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Formula:
C16H13NO5S
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Chemical Name:
2-[2-(4-carboxyanilino)-2-oxoethyl]sulfanylbenzoic acid
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Synonyms:
2-({2-[(4-carboxyphenyl)amino]-2-oxoethyl}sulfanyl)benzoic acid;CHEMBL2234354;ZINC2225146;STK328657;AKOS005437512;MCULE-3527876936;ST45106826;2-{[N-(4-carboxyphenyl)carbamoyl]methylthio}benzoic acid;884803-01-4
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CAS No:
2-[2-(4-carboxyanilino)-2-oxoethyl]sulfanylbenzoic acid Basic Attributes
331.3 g/mol
331.05144369 g/mol
Computed Properties
Molecular Weight:331.3
XLogP3:2.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:331.05144369
Monoisotopic Mass:331.05144369
Topological Polar Surface Area:129
Heavy Atom Count:23
Complexity:448
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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