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Pixantrone

CAT: 0013-GTR19187557-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19187557-02Size:50 mg
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Description
Pixantrone is a synthetic aza-anthracenedione that acts as a DNA intercalator and topoisomerase II inhibitor. It has demonstrated anti-tumor activity in research models, including studies of non-Hodgkin's lymphoma and breast cancer, supporting its investigation in both in vitro and in vivo experimental settings.
CAS Number
144510-96-3
Field of Research
Molecular Biology, Pharmacology & Drug Discovery
Smiles
N (CCN) C1=C2C (=C (NCCN) C=C1) C (=O) C=3C (C2=O) =CC=NC3
Molecular Formula
C17H19N5O2
Molecular Weight
325.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Pixantrone

Pixantrone is a member of isoquinolines.

CAS Number144510-96-3
PubChem CID134019
IUPAC Name6,9-bis(2-aminoethylamino)benzo[g]isoquinoline-5,10-dione
Molecular FormulaC17H19N5O2
Molecular Weight325.4
XLogP1
Topological Polar Surface Area123
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity472
SMILES
C1=CC(=C2C(=C1NCCN)C(=O)C3=C(C2=O)C=NC=C3)NCCN
InChI
InChI=1S/C17H19N5O2/c18-4-7-21-12-1-2-13(22-8-5-19)15-14(12)16(23)10-3-6-20-9-11(10)17(15)24/h1-3,6,9,21-22H,4-5,7-8,18-19H2
InChIKey
PEZPMAYDXJQYRV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pixantrone
CAS: 144510-96-3
CID: 134019
Formula: C17H19N5O2
MW: 325.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight325.4
XLogP31
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass325.15387487
Monoisotopic Mass325.15387487
Topological Polar Surface Area123 Ų
Heavy Atom Count24
Formal Charge0
Complexity472
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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CatalogName
HY-13727A-01Pixantrone
HY-13727AR-01Pixantrone (Standard)
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462726-01Pixantrone Bismaleinamide
A13022-100Pixantrone 100mg
A13022-50Pixantrone 50mg
HY-13727ASPixantrone-d8
MBS5804055Pixantrone hydrochloride

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