midostaurin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 112
Total Number of Articles : 242
PubChem 9829523
Molecular Formula

C35H30N4O4

SMILES

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)N(C)C(=O)C9=CC=CC=C9)OC

InChI

InChI=1S/C35H30N4O4/c1-35-32(42-3)25(37(2)34(41)19-11-5-4-6-12-19)17-26(43-35)38-23-15-9-7-13-20(23)28-29-22(18-36-33(29)40)27-21-14-8-10-16-24(21)39(35)31(27)30(28)38/h4-16,25-26,32H,17-18H2,1-3H3,(H,36,40)/t25-,26-,32-,35+/m1/s1

synonyms
  • Midostaurin
  • PKC412
  • 120685-11-2
Click to show/hide the synonyms
Properties
Property Value
MW 570.6 g/mol
HBD 1
HBA 4
Rotatable Bond Count 3
Exact Mass 570.22670545 g/mol
Monoisotopic Mass 570.22670545 g/mol
Heavy Atom Count 43
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 1140
xlogp 4.8
Topological Polar Surface Area 77.7