4-chloro-2-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid
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![4-chloro-2-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/05f08b3bcfc242d1b9c536508685160e.png "4-chloro-2-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid")
4-chloro-2-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid
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CAS No:
730965-99-8
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Formula:
C16H10ClN3O5S2
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Chemical Name:
4-chloro-2-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid
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Synonyms:
4-chloro-2-{2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoic acid;730965-99-8;ZINC3279598;AKOS000116795;MCULE-7046536296;NE58742;4-chloro-2-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid;EN300-08634;SR-01000047119;SR-01000047119-1
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CAS No:
4-chloro-2-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid Basic Attributes
423.9 g/mol
422.9750405 g/mol
Computed Properties
Molecular Weight:423.9
XLogP3:4.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:422.9750405
Monoisotopic Mass:422.9750405
Topological Polar Surface Area:179
Heavy Atom Count:27
Complexity:593
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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