1-N,4-N-bis[4-(4-amino-1-ethyl-2-iminopyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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![1-N,4-N-bis[4-(4-amino-1-ethyl-2-iminopyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a61221be80634809b844f3dfd7c8b767.png "1-N,4-N-bis[4-(4-amino-1-ethyl-2-iminopyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid")
1-N,4-N-bis[4-(4-amino-1-ethyl-2-iminopyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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CAS No:
17794-13-7
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Formula:
C46H48N10O8S2
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Chemical Name:
1-N,4-N-bis[4-(4-amino-1-ethyl-2-iminopyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
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Synonyms:
NSC 125029;Pyrimidinium, 5,5'-(terephthaloylbis(imino-p-phenylene))bis(2,4-diamino-1-ethyl-, di-p-toluenesulfonate
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CAS No:
1-N,4-N-bis[4-(4-amino-1-ethyl-2-iminopyrimidin-5-yl)phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid Basic Attributes
933.1 g/mol
932.30980087 g/mol
Computed Properties
Molecular Weight:933.1
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:932.30980087
Monoisotopic Mass:932.30980087
Topological Polar Surface Area:315
Heavy Atom Count:66
Complexity:1360
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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