2-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]sulfanylbenzoic acid
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![2-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]sulfanylbenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3416add140cd42bc98d4c56ef503dbb5.png "2-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]sulfanylbenzoic acid")
2-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]sulfanylbenzoic acid
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CAS No:
745790-86-7
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Formula:
C23H14N2O2S2
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Chemical Name:
2-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]sulfanylbenzoic acid
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Synonyms:
ZINC2645072;AKOS034155749;MCULE-9462376327;Z31239264;2-{[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]sulfanyl}benzoic acid;745790-86-7
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CAS No:
2-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]sulfanylbenzoic acid Basic Attributes
414.5 g/mol
414.04967004 g/mol
Computed Properties
Molecular Weight:414.5
XLogP3:6.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:414.04967004
Monoisotopic Mass:414.04967004
Topological Polar Surface Area:117
Heavy Atom Count:29
Complexity:591
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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