3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]benzenesulfonyl fluoride;sulfuric acid
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![3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]benzenesulfonyl fluoride;sulfuric acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/da65bd656baf4ba3a3ecd3e411db3d2d.png "3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]benzenesulfonyl fluoride;sulfuric acid")
3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]benzenesulfonyl fluoride;sulfuric acid
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CAS No:
25313-39-7
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Formula:
C25H21Cl3FN5O8S2
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Chemical Name:
3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]benzenesulfonyl fluoride;sulfuric acid
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Synonyms:
25313-39-7;NSC126231;DTXSID30329498;NSC-126231;Sulfuric acid--3-{[(3-chloro-4-{[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy}phenyl)methyl]carbamoyl}benzene-1-sulfonyl fluoride (1/1)
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CAS No:
3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoyl]benzenesulfonyl fluoride;sulfuric acid Basic Attributes
708.9 g/mol
706.988116 g/mol
126231
DTXSID30329498
Computed Properties
Molecular Weight:708.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:8
Exact Mass:706.988116
Monoisotopic Mass:706.988116
Topological Polar Surface Area:242
Heavy Atom Count:44
Complexity:1020
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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