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AQ-101

CAT: 1410-M11437-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M11437-02Size:5 mg
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Description
AQ-101 is a novel small-molecule anthraquinone analog that induces MDM2 protein degradation (Kd=0.37 uM) through a self-ubiquitination and proteasome-mediated mechanism.
CAS Number
1353384-61-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
331.708
Molecular Formula
C16H10ClNO5
Notes
Research use only, not for human use.
Receptor
MDM2-p53

Chemical Information

1,8-Dihydroxy-3-(2'-chloro-acetamido)-anthraquinone
CAS Number1353384-61-8
PubChem CID56839171
IUPAC Name2-chloro-N-(4,5-dihydroxy-9,10-dioxoanthracen-2-yl)acetamide
Molecular FormulaC16H10ClNO5
Molecular Weight331.70
XLogP2.5
Topological Polar Surface Area104
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity525
SMILES
C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)NC(=O)CCl
InChI
InChI=1S/C16H10ClNO5/c17-6-12(21)18-7-4-9-14(11(20)5-7)16(23)13-8(15(9)22)2-1-3-10(13)19/h1-5,19-20H,6H2,(H,18,21)
InChIKey
FVBACBMWEZTDOY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,8-Dihydroxy-3-(2'-chloro-acetamido)-anthraquinone
CAS: 1353384-61-8
CID: 56839171
Formula: C16H10ClNO5
MW: 331.70
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight331.70
XLogP32.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass331.0247501
Monoisotopic Mass331.0247501
Topological Polar Surface Area104 Ų
Heavy Atom Count23
Formal Charge0
Complexity525
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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