Products for Research Use Only
RegisterLogin

MRS7799

CAT: 0013-GTR19258399-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19258399-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
MRS7799 is a selective A3 Adenosine Receptor antagonist with Kd values of 0.55 nM for humans, 3.74 nM for mice, and 2.80 nM for rats. MRS7799 can be utilized in research related to neurodegenerative diseases, cancer, cardiac and cerebral ischemia, and autoimmune inflammatory diseases.
CAS Number
224040-19-1
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
O=C (NC1=NC (C=2C=C (C=C (C2) C) C) =C (S1) C=3C=CN=CC3) C=4C=NC=CC4
Molecular Formula
C22H18N4OS
Molecular Weight
386.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-[4-(3,5-dimethylphenyl)-5-(4-pyridyl)-1,3-thiazol-2-yl]nicotinamide
CAS Number224040-19-1
PubChem CID22282339
IUPAC NameN-[4-(3,5-dimethylphenyl)-5-pyridin-4-yl-1,3-thiazol-2-yl]pyridine-3-carboxamide
Molecular FormulaC22H18N4OS
Molecular Weight386.5
XLogP4
Topological Polar Surface Area96
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity517
SMILES
CC1=CC(=CC(=C1)C2=C(SC(=N2)NC(=O)C3=CN=CC=C3)C4=CC=NC=C4)C
InChI
InChI=1S/C22H18N4OS/c1-14-10-15(2)12-18(11-14)19-20(16-5-8-23-9-6-16)28-22(25-19)26-21(27)17-4-3-7-24-13-17/h3-13H,1-2H3,(H,25,26,27)
InChIKey
YDXZLBYHXZOWOC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[4-(3,5-dimethylphenyl)-5-(4-pyridyl)-1,3-thiazol-2-yl]nicotinamide
CAS: 224040-19-1
CID: 22282339
Formula: C22H18N4OS
MW: 386.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight386.5
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass386.12013238
Monoisotopic Mass386.12013238
Topological Polar Surface Area96 Ų
Heavy Atom Count28
Formal Charge0
Complexity517
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

Related Products

CatalogName
GTR19212095-01MRS4719
GTR19238471-01MRS7292

Alternative Products

CatalogName
HY-171467MRS7799

Popular Products