4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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![4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220805/ee9413cf1a6e417a9f7326800b308ed4.png "4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid")
4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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CAS No:
25313-16-0
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Formula:
C24H33ClFN7O7S2
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Chemical Name:
4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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Synonyms:
25313-16-0;NSC123980;DTXSID20298528;NSC-123980;Ethanesulfonic acid--4-[({4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy]butyl}carbamoyl)amino]benzene-1-sulfonyl fluoride (1/1)
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CAS No:
4-[4-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]butylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid Basic Attributes
650.1 g/mol
649.1555446 g/mol
123980
DTXSID20298528
Computed Properties
Molecular Weight:650.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:649.1555446
Monoisotopic Mass:649.1555446
Topological Polar Surface Area:236
Heavy Atom Count:42
Complexity:1040
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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