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Tivozanib (AV-951)

CAT: 0607-A2251-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-A2251-10Size:10 mg
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Description
VEGFR inhibitor,potent and selective
CAS Number
475108-18-0
Product Name Alternative
1-[2-chloro-4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-(5-methyl-1,2-oxazol-3-yl)urea
Field of Research
Tyrosine Kinase VEGFR
Purity
0.9826
Form
A solid
Solubility
≥22.75 mg/mL in DMSO; insoluble in H2O; ≥2.68 mg/mL in EtOH with gentle warming
Smiles
CC1=CC(=NO1)NC(=O)NC2=C(C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)Cl
Molecular Formula
C22H19ClN4O5
Molecular Weight
454.86
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Tivozanib

Tivozanib is a member of the class of quinolines that is 6,7-dimethoxyquinoline substituted by a 3-chloro-4-{[(5-methyl-1,2-oxazol-3-yl)carbamoyl]amino}phenoxy group at position 4. It is a potent and selective inhibitor of VEGF receptor tyrosine kinases and was previously in clinical development for the treatment of metastatic renal cell carcinoma. It has a role as an antineoplastic agent, a vascular endothelial growth factor receptor antagonist and an apoptosis inducer. It is a member of phenylureas, a member of quinolines, an aromatic ether, a member of isoxazoles and a member of monochlorobenzenes.

CAS Number475108-18-0
PubChem CID9911830
IUPAC Name1-[2-chloro-4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-(5-methyl-1,2-oxazol-3-yl)urea
Molecular FormulaC22H19ClN4O5
Molecular Weight454.9
XLogP4
Topological Polar Surface Area108
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count32
Formal Charge0
Complexity631
SMILES
CC1=CC(=NO1)NC(=O)NC2=C(C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)Cl
InChI
InChI=1S/C22H19ClN4O5/c1-12-8-21(27-32-12)26-22(28)25-16-5-4-13(9-15(16)23)31-18-6-7-24-17-11-20(30-3)19(29-2)10-14(17)18/h4-11H,1-3H3,(H2,25,26,27,28)
InChIKey
SPMVMDHWKHCIDT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tivozanib
CAS: 475108-18-0
CID: 9911830
Formula: C22H19ClN4O5
MW: 454.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight454.9
XLogP34
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass454.1043974
Monoisotopic Mass454.1043974
Topological Polar Surface Area108 Ų
Heavy Atom Count32
Formal Charge0
Complexity631
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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