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WAY-639418

CAT: 0804-HY-47599-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-47599-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
WAY-639418 is an active molecule for the study of amyloid diseases and synucleinopathies.
CAS Number
643042-43-7
UNSPSC
12352005
Hazard Statement
H315, H319
Target
Drug Derivative
Type
Reference compound
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/way-639418.html
Purity
98.0
Solubility
10 mM in DMSO
Smiles
ClC1=CC=C2C(N3CCN(C4=NC=CC=N4)CC3)=CC=NC2=C1
Molecular Formula
C17H16ClN5
Molecular Weight
325.80
Precautions
H315, H319
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

7-Chloro-4-(4-(pyrimidin-2-yl)piperazin-1-yl)quinoline
CAS Number643042-43-7
PubChem CID4878313
IUPAC Name7-chloro-4-(4-pyrimidin-2-ylpiperazin-1-yl)quinoline
Molecular FormulaC17H16ClN5
Molecular Weight325.8
XLogP3.1
Topological Polar Surface Area45.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity381
SMILES
C1CN(CCN1C2=C3C=CC(=CC3=NC=C2)Cl)C4=NC=CC=N4
InChI
InChI=1S/C17H16ClN5/c18-13-2-3-14-15(12-13)19-7-4-16(14)22-8-10-23(11-9-22)17-20-5-1-6-21-17/h1-7,12H,8-11H2
InChIKey
WFBQKKNGRBFJMC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Chloro-4-(4-(pyrimidin-2-yl)piperazin-1-yl)quinoline
CAS: 643042-43-7
CID: 4878313
Formula: C17H16ClN5
MW: 325.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight325.8
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass325.1094232
Monoisotopic Mass325.1094232
Topological Polar Surface Area45.2 Ų
Heavy Atom Count23
Formal Charge0
Complexity381
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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