spiro-oxindole

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 3
Total Number of Articles : 10
PubChem 24877503
Molecular Formula

C27H32Cl2FN3O4

SMILES

CC(C)(C)C[C@@H]1[C@]2([C@H]([C@@H](N1)C(=O)NCC[C@@H](CO)O)C3=CC(=CC=C3)Cl)C4=CC(=C(C=C4NC2=O)Cl)F

InChI

InChI=1S/C27H32Cl2FN3O4/c1-26(2,3)12-21-27(17-10-19(30)18(29)11-20(17)32-25(27)37)22(14-5-4-6-15(28)9-14)23(33-21)24(36)31-8-7-16(35)13-34/h4-6,9-11,16,21-23,33-35H,7-8,12-13H2,1-3H3,(H,31,36)(H,32,37)/t16-,21+,22-,23+,27-/m0/s1

synonyms
  • 908027-55-4
  • MI-219 free base
  • MI-219
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Properties
Property Value
MW 552.5 g/mol
HBD 5
HBA 6
Rotatable Bond Count 8
Exact Mass 551.1753901 g/mol
Monoisotopic Mass 551.1753901 g/mol
Heavy Atom Count 37
Isotope Atom Count 0
Atom Stereo Count 5
Covalent Unit Count 1
Complexity 845
xlogp 3.7
Topological Polar Surface Area 111