Verapamil

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 921
Total Number of Articles : 2688
PubChem 2520
Molecular Formula

C27H38N2O4

SMILES

CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3

synonyms
  • VERAPAMIL
  • 52-53-9
  • Iproveratril
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Properties
Property Value
MW 454.6 g/mol
HBD 0
HBA 6
Rotatable Bond Count 13
Exact Mass 454.28315770 g/mol
Monoisotopic Mass 454.28315770 g/mol
Heavy Atom Count 33
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 606
xlogp 3.8
Topological Polar Surface Area 64