Bis(3-{[(4-methylphenyl)sulfonyl]amino}propyl)[(4-methylphenyl)sulfonyl]amine

HCID 373797

Basic information

Standard SMILES
Cc1ccc(S(=O)(=O)NCCCN(CCCNS(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1
InChIKey
DGLWWXSXFWPANL-UHFFFAOYSA-N
Molecular formula
C27H35N3O6S3
Average molar mass
593.8 g/mol

Names & identifiers

Preferred name
Bis(3-{[(4-methylphenyl)sulfonyl]amino}propyl)[(4-methylphenyl)sulfonyl]amine
IUPAC
4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-[(4-methylphenyl)sulfonylamino]propyl]amino]propyl]benzenesulfonamide

Names & synonyms

NSC650759SCHEMBL3905679CHEMBL1986878DGLWWXSXFWPANL-UHFFFAOYSA-NAKOS0023134991,5,9-Tritosyl-1,5,9-triazanonaneNSC-650759NCI60_017680ST503312591,5,9-Tris(p-toluenesulfonyl)-1,5,9-triazanonane4-Methyl-N,N-bis(3-(((4-methylphenyl)sulfonyl)amino)propyl)benzenesulfonamidebis(3-{[(4-methylphenyl)sulfonyl]amino}propyl)[(4-methylphenyl)sulfonyl]amine
Show more names
4-methyl-N-[3-[p-tolylsulfonyl-[3-(p-tolylsulfonylamino)propyl]amino]propyl]benzenesulfonamide

Database identifiers

PubChem CID
373797
ChEMBL
CHEMBL1986878

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
155 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
14
Heavy atoms
39

Related reactions

4 records

Compound notes

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