Products for Research Use Only

5MPN

CAT: 0013-GTR19257500-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19257500-01Size:2 mg
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Description
5MPN is a selective, orally active inhibitor of PFKFB4 that competitively targets its F6P binding site. This compound suppresses myeloma cell proliferation in vitro and is a useful tool for investigating metabolic dysregulation in hematological cancers like myeloproliferative neoplasms.
CAS Number
47208-82-2
Product Name Alternative
5MPN, 5-MPN, PFKFB4
Field of Research
Metabolism Research
Purity
97.69% (May vary between batches)
Solubility
DMSO:80 mg/mL (262.01 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (10.81 mM)
Smiles
COc1cccc2c (NCCCCCO[N+] ([O-]) =O) ccnc12
Molecular Formula
C15H19N3O4
Molecular Weight
305.33
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-(n-(8-Methoxy-4-quinolyl)amino)pentyl nitrate

inhibits PFKFB4 protein; structure in first source

CAS Number47208-82-2
PubChem CID4060327
IUPAC Name5-[(8-methoxyquinolin-4-yl)amino]pentyl nitrate
Molecular FormulaC15H19N3O4
Molecular Weight305.33
XLogP3.5
Topological Polar Surface Area89.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count22
Formal Charge0
Complexity337
SMILES
COC1=CC=CC2=C(C=CN=C21)NCCCCCO[N+](=O)[O-]
InChI
InChI=1S/C15H19N3O4/c1-21-14-7-5-6-12-13(8-10-17-15(12)14)16-9-3-2-4-11-22-18(19)20/h5-8,10H,2-4,9,11H2,1H3,(H,16,17)
InChIKey
YBOILUNNGBGURC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-(n-(8-Methoxy-4-quinolyl)amino)pentyl nitrate
CAS: 47208-82-2
CID: 4060327
Formula: C15H19N3O4
MW: 305.33
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight305.33
XLogP33.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass305.13755610
Monoisotopic Mass305.13755610
Topological Polar Surface Area89.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity337
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

Alternative Products

CatalogName
HY-123981-015MPN