A-705253

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 4
Total Number of Articles : 3
PubChem 9848148
Molecular Formula

C30H33N3O3

SMILES

CCN(CC)CC1=CC=C(C=C1)/C=C/C2=CC=CC=C2C(=O)NC(CC3=CC=CC=C3)C(=O)C(=O)N

InChI

InChI=1S/C30H33N3O3/c1-3-33(4-2)21-24-16-14-22(15-17-24)18-19-25-12-8-9-13-26(25)30(36)32-27(28(34)29(31)35)20-23-10-6-5-7-11-23/h5-19,27H,3-4,20-21H2,1-2H3,(H2,31,35)(H,32,36)/b19-18+

synonyms
  • CHEMBL4066494
  • SCHEMBL1335375
  • BDBM50258318
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Properties
Property Value
MW 483.6 g/mol
HBD 2
HBA 4
Rotatable Bond Count 12
Exact Mass 483.25219192 g/mol
Monoisotopic Mass 483.25219192 g/mol
Heavy Atom Count 36
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 734
xlogp 4.9
Topological Polar Surface Area 92.5