1-N,4-N-bis[4-[(2-amino-1-methylpyrimidin-4-ylidene)amino]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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![1-N,4-N-bis[4-[(2-amino-1-methylpyrimidin-4-ylidene)amino]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/7e1a417987224d759fd55fd2205cdaee.png "1-N,4-N-bis[4-[(2-amino-1-methylpyrimidin-4-ylidene)amino]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid")
1-N,4-N-bis[4-[(2-amino-1-methylpyrimidin-4-ylidene)amino]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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CAS No:
20814-50-0
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Formula:
C44H44N10O8S2
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Chemical Name:
1-N,4-N-bis[4-[(2-amino-1-methylpyrimidin-4-ylidene)amino]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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Synonyms:
NSC 125027;Pyrimidinium, 4,4'-(terephthaloylbis(imino-p-phenyleneimino))bis(2-amino-1-methyl-, di-p-toluenesulfonate
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CAS No:
1-N,4-N-bis[4-[(2-amino-1-methylpyrimidin-4-ylidene)amino]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:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:904.27850075
Monoisotopic Mass:904.27850075
Topological Polar Surface Area:292
Heavy Atom Count:64
Complexity:1290
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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