Ezetimibe

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 238
Total Number of Articles : 568
PubChem 150311
Molecular Formula

C24H21F2NO3

SMILES

C1=CC(=CC=C1[C@@H]2[C@H](C(=O)N2C3=CC=C(C=C3)F)CC[C@@H](C4=CC=C(C=C4)F)O)O

InChI

InChI=1S/C24H21F2NO3/c25-17-5-1-15(2-6-17)22(29)14-13-21-23(16-3-11-20(28)12-4-16)27(24(21)30)19-9-7-18(26)8-10-19/h1-12,21-23,28-29H,13-14H2/t21-,22+,23-/m1/s1

synonyms
  • Ezetimibe
  • 163222-33-1
  • Zetia
Click to show/hide the synonyms
Properties
Property Value
MW 409.4 g/mol
HBD 2
HBA 5
Rotatable Bond Count 6
Exact Mass 409.14894986 g/mol
Monoisotopic Mass 409.14894986 g/mol
Heavy Atom Count 30
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 567
xlogp 4
Topological Polar Surface Area 60.8