3-[[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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![3-[[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220805/c56dffe6e741408999cc51238ed8ffe1.png "3-[[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid")
3-[[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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CAS No:
21316-21-2
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Formula:
C21H28FN7O6S2
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Chemical Name:
3-[[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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Synonyms:
21316-21-2;NSC122137;DTXSID50298278;NSC-122137;Ethanesulfonic acid--3-[({[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl]methyl}carbamoyl)amino]benzene-1-sulfonyl fluoride (1/1)
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CAS No:
3-[[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid Basic Attributes
557.6 g/mol
557.15265215 g/mol
122137
DTXSID50298278
Computed Properties
Molecular Weight:557.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:557.15265215
Monoisotopic Mass:557.15265215
Topological Polar Surface Area:226
Heavy Atom Count:37
Complexity:937
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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