2-[3-(4-fluoroanilino)-3-oxopropyl]sulfanylbenzoic acid
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![2-[3-(4-fluoroanilino)-3-oxopropyl]sulfanylbenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/192ddd4179784e918e89e0533247ac63.png "2-[3-(4-fluoroanilino)-3-oxopropyl]sulfanylbenzoic acid")
2-[3-(4-fluoroanilino)-3-oxopropyl]sulfanylbenzoic acid
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CAS No:
380491-12-3
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Formula:
C16H14FNO3S
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Chemical Name:
2-[3-(4-fluoroanilino)-3-oxopropyl]sulfanylbenzoic acid
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Synonyms:
Enamine_002536;Oprea1_230173;HMS1401D06;ZINC3233376;AKOS034459201;MCULE-2273478482;IDI1_006883;SR-01000033285;SR-01000033285-1;Z56833752;2-({2-[(4-fluorophenyl)carbamoyl]ethyl}sulfanyl)benzoic acid;380491-12-3
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CAS No:
2-[3-(4-fluoroanilino)-3-oxopropyl]sulfanylbenzoic acid Basic Attributes
319.4 g/mol
319.06784264 g/mol
Computed Properties
Molecular Weight:319.4
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:319.06784264
Monoisotopic Mass:319.06784264
Topological Polar Surface Area:91.7
Heavy Atom Count:22
Complexity:386
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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