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VX-702

CAT: 0013-GTR19153393-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19153393-01Size:5 mg
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Description
VX-702 (also known as VX702; CAS number: 479543-46-9) is a compound with a molecular weight of 404.32 Da and a purity of ≥98%.
CAS Number
479543-46-9
Product Name Alternative
VX702
Purity
≥98%
Solubility
DMSO 81 mg/mL (200.34 mM) Water Insoluble Ethanol Insoluble
Smiles
C1cc (c (c (c1) F) N (c2ccc (c (n2) c3ccc (cc3F) F) C (=O) N) C (=O) N) F
Molecular Formula
C19H12F4N4O2
Molecular Weight
404.32
Storage Conditions
Storage Temp: -20°C
Notes
For research use only.

Chemical Information

Vx-702

6-(N-carbamoyl-2,6-difluoroanilino)-2-(2,4-difluorophenyl)-3-pyridinecarboxamide is a phenylpyridine.

CAS Number479543-46-9
PubChem CID10341154
IUPAC Name6-(N-carbamoyl-2,6-difluoroanilino)-2-(2,4-difluorophenyl)pyridine-3-carboxamide
Molecular FormulaC19H12F4N4O2
Molecular Weight404.3
XLogP2.5
Topological Polar Surface Area102
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity603
SMILES
C1=CC(=C(C(=C1)F)N(C2=NC(=C(C=C2)C(=O)N)C3=C(C=C(C=C3)F)F)C(=O)N)F
InChI
InChI=1S/C19H12F4N4O2/c20-9-4-5-10(14(23)8-9)16-11(18(24)28)6-7-15(26-16)27(19(25)29)17-12(21)2-1-3-13(17)22/h1-8H,(H2,24,28)(H2,25,29)
InChIKey
FYSRKRZDBHOFAY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vx-702
CAS: 479543-46-9
CID: 10341154
Formula: C19H12F4N4O2
MW: 404.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight404.3
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass404.08963829
Monoisotopic Mass404.08963829
Topological Polar Surface Area102 Ų
Heavy Atom Count29
Formal Charge0
Complexity603
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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Alternative Products

CatalogName
HY-10401-01VX-702
sc-361400VX 702

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