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MK-0249

CAT: 0013-GTR19205393-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19205393-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
MK-0249 is a potent and selective oral histamine H3 receptor antagonist (IC50 = 1.7 nM) . It is utilized in preclinical research for investigating cognitive and attention disorders, such as ADHD, through both in vitro binding assays and in vivo behavioral models.
CAS Number
862309-06-6
Product Name Alternative
MK 0249, MK0249, MK-0249, Human H3, HistamineReceptor, Histamine Receptor, H3 receptor
Field of Research
Immunology & Inflammation, Neuroscience, Pharmacology & Drug Discovery
Purity
99.76% (May vary between batches)
Smiles
Cc1nc2cccc (c2c (=O) n1-c1ccc (OCCCN2CCCC2) cc1) C (F) (F) F
Molecular Formula
C23H24F3N3O2
Molecular Weight
431.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Mk-0249

MK0249 has been used in trials studying the treatment of Hypopnea Syndrome, Alzheimer's Disease, Paranoid Schizophrenia, Sleep Apnea, Obstructive, and Excessive Daytime Sleepiness, among others.

CAS Number862309-06-6
PubChem CID11697697
IUPAC Name2-methyl-3-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-5-(trifluoromethyl)quinazolin-4-one
Molecular FormulaC23H24F3N3O2
Molecular Weight431.4
XLogP4.2
Topological Polar Surface Area45.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count31
Formal Charge0
Complexity655
SMILES
CC1=NC2=CC=CC(=C2C(=O)N1C3=CC=C(C=C3)OCCCN4CCCC4)C(F)(F)F
InChI
InChI=1S/C23H24F3N3O2/c1-16-27-20-7-4-6-19(23(24,25)26)21(20)22(30)29(16)17-8-10-18(11-9-17)31-15-5-14-28-12-2-3-13-28/h4,6-11H,2-3,5,12-15H2,1H3
InChIKey
DDDZBLNULGDPGA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mk-0249
CAS: 862309-06-6
CID: 11697697
Formula: C23H24F3N3O2
MW: 431.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight431.4
XLogP34.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass431.18206150
Monoisotopic Mass431.18206150
Topological Polar Surface Area45.1 Ų
Heavy Atom Count31
Formal Charge0
Complexity655
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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BA5436-1MK-0249
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M33026-01MK-0249 B
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T210268-01NT-0249 free base
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