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PKI-166

CAT: 0013-GTR19203251-03Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19203251-03Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
PKI-166 is a potent and selective oral EGF-R tyrosine kinase inhibitor (IC50: 0.7 nM) . It has demonstrated efficacy in inhibiting the growth and metastasis of various human cancer cell lines, including pancreatic cancer, in both in vitro and in vivo preclinical studies.
CAS Number
187724-61-4
Product Name Alternative
EGFR tyrosine kinase, PKI 166, PKI166, PKI-166, VEGFR
Field of Research
Cardiovascular Research, Signal Transduction
Purity
99.20% (May vary between batches)
Solubility
DMSO:27.5 mg/mL (83.24 mM)
Smiles
C[C@@H] (Nc1ncnc2[nH]c (cc12) -c1ccc (O) cc1) c1ccccc1
Molecular Formula
C20H18N4O
Molecular Weight
330.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Pki-166

EGFR/HER1/HER2 Inhibitor PKI166 is a pyrrolo-pyrimidine epidermal growth factor receptor (EGFR) protein kinase inhibitor with anti-tumor activity. PKI-166 reversibly inhibits HER1 and HER2 tyrosine kinases, belong to the epidermal growth factor receptor family, thereby inhibiting tumor growth and metastasis.

CAS Number187724-61-4
PubChem CID6918403
IUPAC Name4-[4-[[(1R)-1-phenylethyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenol
Molecular FormulaC20H18N4O
Molecular Weight330.4
XLogP4.2
Topological Polar Surface Area73.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity420
SMILES
C[C@H](C1=CC=CC=C1)NC2=NC=NC3=C2C=C(N3)C4=CC=C(C=C4)O
InChI
InChI=1S/C20H18N4O/c1-13(14-5-3-2-4-6-14)23-19-17-11-18(24-20(17)22-12-21-19)15-7-9-16(25)10-8-15/h2-13,25H,1H3,(H2,21,22,23,24)/t13-/m1/s1
InChIKey
XRYJULCDUUATMC-CYBMUJFWSA-N
Chemical Structure
2D Structure
2D structure of Pki-166
CAS: 187724-61-4
CID: 6918403
Formula: C20H18N4O
MW: 330.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight330.4
XLogP34.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass330.14806121
Monoisotopic Mass330.14806121
Topological Polar Surface Area73.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity420
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
BA6356-25PKI-166
HY-110328PKI-166 (hydrochloride)
T36643PKI-166 hydrochloride
256278PKI 166 hydrochloride
A8505-5PKI-402
BA8711-5.1PKI-179
5-01772PKI-tide
329788-01Pki alpha
345376-01PKI β discontinued

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