4-[[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetyl]amino]benzoic acid
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![4-[[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7cf65a7004d146e88f9b138bc7f0495d.png "4-[[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetyl]amino]benzoic acid")
4-[[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetyl]amino]benzoic acid
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CAS No:
421584-58-9
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Formula:
C17H15N3O3S
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Chemical Name:
4-[[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetyl]amino]benzoic acid
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Synonyms:
ZINC3278305;AKOS034442513;MCULE-7906678408;SR-01000500781;SR-01000500781-1;Z54718071;4-{2-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetamido}benzoic acid;421584-58-9
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CAS No:
4-[[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetyl]amino]benzoic acid Basic Attributes
341.4 g/mol
341.08341252 g/mol
Computed Properties
Molecular Weight:341.4
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:341.08341252
Monoisotopic Mass:341.08341252
Topological Polar Surface Area:128
Heavy Atom Count:24
Complexity:511
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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