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WHI-P258

CAT: 0804-HY-108419-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-108419-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
WHI-P258, a quinazoline compound, binds to the active site of JAK3 with an estimated Ki of 72 µM. WHI-P258 does not inhibit JAK3 and does not affect the thrombin-induced aggregation of platelets even at 100 μM[1][2].
CAS Number
21561-09-1
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
JNK
Type
Reference compound
Related Pathways
MAPK/ERK Pathway
Applications
Neuroscience-Neuromodulation
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/whi-p258.html
Purity
99.91
Solubility
DMSO : 31.25 mg/mL (ultrasonic)
Smiles
COC1=CC2=NC=NC(NC3=CC=CC=C3)=C2C=C1OC
Molecular Formula
C16H15N3O2
Molecular Weight
281.31
Precautions
H302, H315, H319, H335
References & Citations
[1]Sudbeck EA, et al. Structure-based design of specific inhibitors of Janus kinase 3 as apoptosis-inducing antileukemic agents. Clin Cancer Res. 1999 Jun;5 (6) :1569-82.|[2]Tibbles HE, et al. Role of a JAK3-dependent biochemical signaling pathway in platelet activation and aggregation. J Biol Chem. 2001 May 25;276 (21) :17815-22.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

6,7-dimethoxy-N-phenylquinazolin-4-amine
CAS Number21561-09-1
PubChem CID3798
IUPAC Name6,7-dimethoxy-N-phenylquinazolin-4-amine
Molecular FormulaC16H15N3O2
Molecular Weight281.31
XLogP3.4
Topological Polar Surface Area56.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity323
SMILES
COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC=C3)OC
InChI
InChI=1S/C16H15N3O2/c1-20-14-8-12-13(9-15(14)21-2)17-10-18-16(12)19-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,18,19)
InChIKey
MJKCGAHOCZLYDG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6,7-dimethoxy-N-phenylquinazolin-4-amine
CAS: 21561-09-1
CID: 3798
Formula: C16H15N3O2
MW: 281.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight281.31
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass281.116426730
Monoisotopic Mass281.116426730
Topological Polar Surface Area56.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity323
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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