Products for Research Use Only

COX-1-IN-1

CAT: 0013-GTR19235591-01Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19235591-01Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
COX-1-IN-1 (15a) is a potent and highly selective COX-1 inhibitor with an IC50 of 0.23 μM and a selectivity index of 217 over COX-2. This compound effectively suppresses platelet aggregation in vitro, making it a valuable research tool for studying thrombosis and inflammation models.
CAS Number
1369503-03-6
Field of Research
Immunology & Inflammation, Metabolism Research, Neuroscience
Smiles
CC1=C (C (=NO1) C2=CC=C (OCC) C=C2) C3=CC=C (OCC) C=C3
Molecular Formula
C20H21NO3
Molecular Weight
323.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cox-1-IN-1
CAS Number1369503-03-6
PubChem CID170836246
IUPAC Name3,4-bis(4-ethoxyphenyl)-5-methyl-1,2-oxazole
Molecular FormulaC20H21NO3
Molecular Weight323.4
XLogP4.7
Topological Polar Surface Area44.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity362
SMILES
CCOC1=CC=C(C=C1)C2=C(ON=C2C3=CC=C(C=C3)OCC)C
InChI
InChI=1S/C20H21NO3/c1-4-22-17-10-6-15(7-11-17)19-14(3)24-21-20(19)16-8-12-18(13-9-16)23-5-2/h6-13H,4-5H2,1-3H3
InChIKey
BCOIWKZLSWINMZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cox-1-IN-1
CAS: 1369503-03-6
CID: 170836246
Formula: C20H21NO3
MW: 323.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight323.4
XLogP34.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass323.15214353
Monoisotopic Mass323.15214353
Topological Polar Surface Area44.5 Ų
Heavy Atom Count24
Formal Charge0
Complexity362
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