3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]-4-methylbenzenesulfonyl fluoride;sulfuric acid
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![3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]-4-methylbenzenesulfonyl fluoride;sulfuric acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e99c22c78c0047979497ddc62a3248ab.png "3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]-4-methylbenzenesulfonyl fluoride;sulfuric acid")
3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]-4-methylbenzenesulfonyl fluoride;sulfuric acid
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CAS No:
20105-66-2
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Formula:
C26H24Cl2FN5O8S2
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Chemical Name:
3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]-4-methylbenzenesulfonyl fluoride;sulfuric acid
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Synonyms:
20105-66-2;NSC211053;DTXSID80330170;NSC-211053;Sulfuric acid--3-{[(4-{[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy}phenyl)methyl]carbamoyl}-4-methylbenzene-1-sulfonyl fluoride (1/1)
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CAS No:
3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]-4-methylbenzenesulfonyl fluoride;sulfuric acid Basic Attributes
688.5 g/mol
687.0427386 g/mol
211053
DTXSID80330170
Computed Properties
Molecular Weight:688.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:8
Exact Mass:687.0427386
Monoisotopic Mass:687.0427386
Topological Polar Surface Area:242
Heavy Atom Count:44
Complexity:1000
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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