osimertinib

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 235
Total Number of Articles : 830
PubChem 71496458
Molecular Formula

C28H33N7O2

SMILES

CN1C=C(C2=CC=CC=C21)C3=NC(=NC=C3)NC4=C(C=C(C(=C4)NC(=O)C=C)N(C)CCN(C)C)OC

InChI

InChI=1S/C28H33N7O2/c1-7-27(36)30-22-16-23(26(37-6)17-25(22)34(4)15-14-33(2)3)32-28-29-13-12-21(31-28)20-18-35(5)24-11-9-8-10-19(20)24/h7-13,16-18H,1,14-15H2,2-6H3,(H,30,36)(H,29,31,32)

synonyms
  • osimertinib
  • 1421373-65-0
  • AZD-9291
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Properties
Property Value
MW 499.6 g/mol
HBD 2
HBA 7
Rotatable Bond Count 10
Exact Mass 499.26957332 g/mol
Monoisotopic Mass 499.26957332 g/mol
Heavy Atom Count 37
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 752
xlogp 3.7
Topological Polar Surface Area 87.6