48B

2-chloro-N-[4-({5-fluoro-2-[(4-hydroxyphenyl)amino]pyrimidin-4-yl}amino)phenyl]benzamide


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Chemical Component Summary

Name2-chloro-N-[4-({5-fluoro-2-[(4-hydroxyphenyl)amino]pyrimidin-4-yl}amino)phenyl]benzamide
Identifiers2-chloro-N-[4-[[5-fluoro-2-[(4-hydroxyphenyl)amino]pyrimidin-4-yl]amino]phenyl]benzamide
FormulaC23 H17 Cl F N5 O2
Molecular Weight449.865
TypeNON-POLYMER
Isomeric SMILESc1ccc(c(c1)C(=O)Nc2ccc(cc2)Nc3c(cnc(n3)Nc4ccc(cc4)O)F)Cl
InChIInChI=1S/C23H17ClFN5O2/c24-19-4-2-1-3-18(19)22(32)28-15-7-5-14(6-8-15)27-21-20(25)13-26-23(30-21)29-16-9-11-17(31)12-10-16/h1-13,31H,(H,28,32)(H2,26,27,29,30)
InChIKeyZYURNHOEBWWJHI-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count49
Chiral Atom Count0
Bond Count52
Aromatic Bond Count24

Related Resource References

Resource NameReference
Pharos CHEMBL523991
PubChem 42628076
ChEMBL CHEMBL523991