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ML379

CAT: 1410-M12450Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1410-M12450Size:1 Each
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Description
ML379 (CID71576758) is a potent, selective TP53 mutant cancer cells inhibitor with IC50 of 13 nM in sensitive HeLa cells (TP53 mutant) .
CAS Number
1630760-58-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
273.33
Molecular Formula
C15H19N3O2
Notes
Research use only, not for human use.
Receptor
MDM2-p53

Chemical Information

Dnmdp-3
CAS Number1630760-58-5
PubChem CID71576758
IUPAC Name(4R)-4-methyl-3-(4-morpholin-4-ylphenyl)-4,5-dihydro-1H-pyridazin-6-one
Molecular FormulaC15H19N3O2
Molecular Weight273.33
XLogP1.2
Topological Polar Surface Area53.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity383
SMILES
C[C@@H]1CC(=O)NN=C1C2=CC=C(C=C2)N3CCOCC3
InChI
InChI=1S/C15H19N3O2/c1-11-10-14(19)16-17-15(11)12-2-4-13(5-3-12)18-6-8-20-9-7-18/h2-5,11H,6-10H2,1H3,(H,16,19)/t11-/m1/s1
InChIKey
AUJRLIIKYCIXHN-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of Dnmdp-3
CAS: 1630760-58-5
CID: 71576758
Formula: C15H19N3O2
MW: 273.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight273.33
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass273.147726857
Monoisotopic Mass273.147726857
Topological Polar Surface Area53.9 Ų
Heavy Atom Count20
Formal Charge0
Complexity383
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
MBS3602450ML379

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