3-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;sulfuric acid
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![3-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;sulfuric acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5548588bc96a41bf9e2364f4d0b7b657.png "3-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;sulfuric acid")
3-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;sulfuric acid
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CAS No:
20096-75-7
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Formula:
C26H25Cl2FN6O7S2
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Chemical Name:
3-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;sulfuric acid
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Synonyms:
20096-75-7;NSC120939;DTXSID50329399;NSC-120939;DS-014031;3-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;Sulfuric acid--3-({[(4-{2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl}phenyl)methyl]carbamoyl}amino)benzene-1-sulfonyl fluoride (1/1)
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CAS No:
3-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;sulfuric acid Basic Attributes
687.5 g/mol
686.0587231 g/mol
120939
DTXSID50329399
Computed Properties
Molecular Weight:687.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:686.0587231
Monoisotopic Mass:686.0587231
Topological Polar Surface Area:244
Heavy Atom Count:44
Complexity:988
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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