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413599-62-9

413599-62-9 | ZD-4190

CAS No: 413599-62-9 Catalog No: AG01FPEQ MDL No:

Product Description

Catalog Number:
AG01FPEQ
Chemical Name:
ZD-4190
CAS Number:
413599-62-9
Molecular Formula:
C19H16BrFN6O2
Molecular Weight:
459.2717
IUPAC Name:
N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[2-(triazol-1-yl)ethoxy]quinazolin-4-amine
InChI:
InChI=1S/C19H16BrFN6O2/c1-28-17-9-13-16(10-18(17)29-7-6-27-5-4-24-26-27)22-11-23-19(13)25-15-3-2-12(20)8-14(15)21/h2-5,8-11H,6-7H2,1H3,(H,22,23,25)
InChI Key:
YBTGTVGEKMZEQX-UHFFFAOYSA-N
SMILES:
COc1cc2c(ncnc2cc1OCCn1nncc1)Nc1ccc(cc1F)Br

Properties

Complexity:
523  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
458.05g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
459.279g/mol
Monoisotopic Mass:
458.05g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Literature

Title Journal
PET imaging of early response to the tyrosine kinase inhibitor ZD4190. European journal of nuclear medicine and molecular imaging 20110701
The antiangiogenic agent ZD4190 prevents tumour outgrowth in a model of minimal residual carcinoma in deep tissues. British journal of cancer 20090804
Use of a novel Arg-Gly-Asp radioligand, 18F-AH111585, to determine changes in tumor vascularity after antitumor therapy. Journal of nuclear medicine : official publication, Society of Nuclear Medicine 20090101
Inhibition of vascular endothelial growth factor (VEGF)-165 and semaphorin 3A-mediated cellular invasion and tumor growth by the VEGF signaling inhibitor ZD4190 in human colon cancer cells and xenografts. Molecular cancer therapeutics 20060801
Reduced capillary perfusion and permeability in human tumour xenografts treated with the VEGF signalling inhibitor ZD4190: an in vivo assessment using dynamic MR imaging and macromolecular contrast media. Magnetic resonance imaging 20031001
Dynamic contrast-enhanced MRI of vascular changes induced by the VEGF-signalling inhibitor ZD4190 in human tumour xenografts. Magnetic resonance imaging 20030601
Novel 4-anilinoquinazolines with C-7 basic side chains: design and structure activity relationship of a series of potent, orally active, VEGF receptor tyrosine kinase inhibitors. Journal of medicinal chemistry 20020314
Design and structure-activity relationship of a new class of potent VEGF receptor tyrosine kinase inhibitors. Journal of medicinal chemistry 19991230

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