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VS 8

CAT: 0931-T63147-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T63147-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2471865-38-8
Target
Others, Apoptosis, VEGFR, Reactive Oxygen Species
Related Pathways
Apoptosis, Metabolism, Tyrosine Kinase/Adaptors, Angiogenesis, Immunology/Inflammation, NF-κB, Others
Bioactivity
VS 8 (Compound VS 8) is a potent, orally active VEGFR-2 inhibitor exhibiting significant anti-angiogenic effects, inducing apoptosis and migration of cancer cells, and demonstrating activity against CSCs (cancer stem cells) .
Smiles
O(C=1C2=C(C(NC(NC3=CC(C(F)(F)F)=CC=C3)=O)=CC=C2)C=CC1)C4=CC=C(NC(C)=O)C=C4
Molecular Formula
C26H20F3N3O3
Molecular Weight
479.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-[4-[5-[[3-(trifluoromethyl)phenyl]carbamoylamino]naphthalen-1-yl]oxyphenyl]acetamide
CAS Number2471865-38-8
PubChem CID162653073
IUPAC NameN-[4-[5-[[3-(trifluoromethyl)phenyl]carbamoylamino]naphthalen-1-yl]oxyphenyl]acetamide
Molecular FormulaC26H20F3N3O3
Molecular Weight479.4
XLogP5.3
Topological Polar Surface Area79.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count35
Formal Charge0
Complexity726
SMILES
CC(=O)NC1=CC=C(C=C1)OC2=CC=CC3=C2C=CC=C3NC(=O)NC4=CC=CC(=C4)C(F)(F)F
InChI
InChI=1S/C26H20F3N3O3/c1-16(33)30-18-11-13-20(14-12-18)35-24-10-4-7-21-22(24)8-3-9-23(21)32-25(34)31-19-6-2-5-17(15-19)26(27,28)29/h2-15H,1H3,(H,30,33)(H2,31,32,34)
InChIKey
ZCMXAYQHMRJMHV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[4-[5-[[3-(trifluoromethyl)phenyl]carbamoylamino]naphthalen-1-yl]oxyphenyl]acetamide
CAS: 2471865-38-8
CID: 162653073
Formula: C26H20F3N3O3
MW: 479.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight479.4
XLogP35.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass479.14567599
Monoisotopic Mass479.14567599
Topological Polar Surface Area79.5 Ų
Heavy Atom Count35
Formal Charge0
Complexity726
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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