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P53-Mdm2 inhibitor 4

CAT: 1410-M35928-01Size: 1 EachDry Ice: NoHazardous: No
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Description
P53-Mdm2 inhibitor 4 inhibits the p53-MDM2 protein-protein interaction.
CAS Number
350678-63-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
405.42
Molecular Formula
C23H20FN3O3
Notes
Research use only, not for human use.
Receptor
Mdm2 | p53

Chemical Information

4-benzoyl-5-(4-fluorophenyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-2,5-dihydro-1H-pyrrol-2-one
CAS Number350678-63-6
PubChem CID5819340
IUPAC Name(4E)-5-(4-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione
Molecular FormulaC23H20FN3O3
Molecular Weight405.4
XLogP3.1
Topological Polar Surface Area75.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count30
Formal Charge0
Complexity669
SMILES
C1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=C(C=C4)F)/O
InChI
InChI=1S/C23H20FN3O3/c24-18-9-7-16(8-10-18)20-19(21(28)17-5-2-1-3-6-17)22(29)23(30)27(20)13-4-12-26-14-11-25-15-26/h1-3,5-11,14-15,20,28H,4,12-13H2/b21-19+
InChIKey
WZHIJKGQYGXRHB-XUTLUUPISA-N
Chemical Structure
2D Structure
2D structure of 4-benzoyl-5-(4-fluorophenyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-2,5-dihydro-1H-pyrrol-2-one
CAS: 350678-63-6
CID: 5819340
Formula: C23H20FN3O3
MW: 405.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight405.4
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass405.14886967
Monoisotopic Mass405.14886967
Topological Polar Surface Area75.4 Ų
Heavy Atom Count30
Formal Charge0
Complexity669
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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