1-N,4-N-bis[4-(4-amino-2-imino-1-methylpyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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![1-N,4-N-bis[4-(4-amino-2-imino-1-methylpyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a821ae15e916454782ecfa1d7a3e3db4.png "1-N,4-N-bis[4-(4-amino-2-imino-1-methylpyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid")
1-N,4-N-bis[4-(4-amino-2-imino-1-methylpyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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CAS No:
20719-34-0
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Formula:
C44H44N10O8S2
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Chemical Name:
1-N,4-N-bis[4-(4-amino-2-imino-1-methylpyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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Synonyms:
NSC 125026;Pyrimidinium, 5,5'-(terephthaloylbis(imino-p-phenylene))bis(2,4-diamino-1-methyl-, di-p-toluenesulfonate
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CAS No:
1-N,4-N-bis[4-(4-amino-2-imino-1-methylpyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid Basic Attributes
905.0 g/mol
904.27850075 g/mol
Computed Properties
Molecular Weight:905.0
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:904.27850075
Monoisotopic Mass:904.27850075
Topological Polar Surface Area:315
Heavy Atom Count:64
Complexity:1320
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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