4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide
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![4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d94a01c77cda41e9adf8830185c5a73e.png "4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide")
4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide
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CAS No:
219832-49-2
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Formula:
C27H25N3O4S2
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Chemical Name:
4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide
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Synonyms:
MP-A08;219832-49-2;MP A08;CHEMBL3764617;4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide;NSC122314;MPA08;SCHEMBL17443540;SCHEMBL22126683;GTPL10219;CHEBI:167665;BDBM50139649;ZINC16923203;AKOS026669542;ZINC103938827;CS-5681;MCULE-6662772127;NSC 122314;NSC-122314;HY-19794;N-[2-[[2-(Tosylamino)benzylidene]amino]phenyl]-4-methylbenzenesulfonamide;4-Methyl-N-[2-[[[2-[[(4-methylphenyl)sulfonyl]amino]phenyl]imino]methyl]phenyl]-benzenesulfonamide;4-Methyl-N-[2-[[[2-[[(4-methylphenyl)sulfonyl]amino]phenyl]imino]methyl]phenyl]benzenesulfonamide;4-methyl-N-{2-[(2-{[(4-methylphenyl)sulfonyl]amino}benzylidene)amino]phenyl}benzenesulfonamide
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CAS No:
Description
MP-A08 is a sulfonamide that consists of two moieties of 4-methyl-N-phenylbenzenesulfonamide connected to each other at position 2 by an aldimine linker. It is a ATP-competitive inhibitor of sphingosine kinase that targets both SK1 and SK2 (Ki values of 27 muM and 6.9 muM, respectively) and exhibits anti-cancer properties. It has a role as an antineoplastic agent, an apoptosis inducer, an angiogenesis inhibitor and an EC 2.7.1.91 (sphingosine kinase) inhibitor. It is a sulfonamide, a member of toluenes and an aldimine.
4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide Basic Attributes
519.6 g/mol
519.12864863 g/mol
122314
Computed Properties
Molecular Weight:519.6
XLogP3:5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:519.12864863
Monoisotopic Mass:519.12864863
Topological Polar Surface Area:122
Heavy Atom Count:36
Complexity:925
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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