2-Methyl-5-[[4-[methyl-[1-methyl-2-(2-phenylethylamino)benzimidazol-5-yl]amino]pyrimidin-2-yl]amino]benzenesulfonamide

HCID 10129064
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Basic information

Standard SMILES
Cc1ccc(Nc2nccc(N(C)c3ccc4c(c3)nc(NCCc3ccccc3)n4C)n2)cc1S(N)(=O)=O
InChIKey
RQJPOCJOUXFQBE-UHFFFAOYSA-N
Molecular formula
C28H30N8O2S
Average molar mass
542.7 g/mol

Names & identifiers

Preferred name
2-Methyl-5-[[4-[methyl-[1-methyl-2-(2-phenylethylamino)benzimidazol-5-yl]amino]pyrimidin-2-yl]amino]benzenesulfonamide
IUPAC
2-methyl-5-[[4-[methyl-[1-methyl-2-(2-phenylethylamino)benzimidazol-5-yl]amino]pyrimidin-2-yl]amino]benzenesulfonamide

Names & synonyms

SCHEMBL4976604

Database identifiers

PubChem CID
10129064

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
139 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
9
Rotatable bonds
9
Heavy atoms
39

Related reactions

1 records
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Compound notes

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