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U46,195

CAT: 0013-GTR19209120-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209120-02Size:50 mg
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Description
U46,195 is a dual-function small molecule that acts as a platelet-activating factor (PAF) receptor antagonist and induces tissue-type plasminogen activator (tPA) production. It is utilized in cardiovascular and thrombosis research, with applications in both in vitro and in vivo studies of fibrinolysis and inflammatory pathways.
CAS Number
141490-47-3
Smiles
ClC=1C=C2C (N3C (CN=C2C4=CC (O) =CC=C4) =NN=C3C) =CC1
Molecular Formula
C17H13ClN4O
Molecular Weight
324.76
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

U46,195

stimulates the production of tissue-type plasminogen activator; structure in second source; PAF antagonist

CAS Number141490-47-3
PubChem CID126604
IUPAC Name3-(8-chloro-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-6-yl)phenol
Molecular FormulaC17H13ClN4O
Molecular Weight324.8
XLogP1.8
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity474
SMILES
CC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC(=CC=C4)O
InChI
InChI=1S/C17H13ClN4O/c1-10-20-21-16-9-19-17(11-3-2-4-13(23)7-11)14-8-12(18)5-6-15(14)22(10)16/h2-8,23H,9H2,1H3
InChIKey
GGQZNQSJWZEGBR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of U46,195
CAS: 141490-47-3
CID: 126604
Formula: C17H13ClN4O
MW: 324.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight324.8
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass324.0777887
Monoisotopic Mass324.0777887
Topological Polar Surface Area63.3 Ų
Heavy Atom Count23
Formal Charge0
Complexity474
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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