2-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid
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![2-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0ac723d6b55d4814ba5045a932cbdbfb.png "2-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid")
2-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid
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CAS No:
721886-95-9
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Formula:
C18H20N2O3S
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Chemical Name:
2-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid
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Synonyms:
ZINC3287545;AKOS034448683;MCULE-6593220071;Z55950397;2-[({[2-methyl-6-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]pyridine-3-carboxylic acid;721886-95-9
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CAS No:
2-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Basic Attributes
344.4 g/mol
344.11946368 g/mol
Computed Properties
Molecular Weight:344.4
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:344.11946368
Monoisotopic Mass:344.11946368
Topological Polar Surface Area:105
Heavy Atom Count:24
Complexity:444
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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