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VU0071063

CAT: 0013-GTR19155292-05Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155292-05Size:50 mg
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Description
VU0071063 is a Kir6.2/SUR1 activator.
CAS Number
333415-38-6
Product Name Alternative
VU-0071063 | VU 0071063
Purity
>98% (HPLC)
Solubility
DMSO:10 mM
Smiles
O=C (N1C) N (C) C2=C (N (CC3=CC=C (C (C) (C) C) C=C3) C=N2) C1=O
Molecular Formula
C18H22N4O2
Molecular Weight
326.4
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

7-(4-(tert-butyl)benzyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione

an activator of Kir6.2/SUR1; structure in first source

CAS Number333415-38-6
PubChem CID590142
IUPAC Name7-[(4-tert-butylphenyl)methyl]-1,3-dimethylpurine-2,6-dione
Molecular FormulaC18H22N4O2
Molecular Weight326.4
XLogP2.8
Topological Polar Surface Area58.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity508
SMILES
CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C
InChI
InChI=1S/C18H22N4O2/c1-18(2,3)13-8-6-12(7-9-13)10-22-11-19-15-14(22)16(23)21(5)17(24)20(15)4/h6-9,11H,10H2,1-5H3
InChIKey
ZFZAIHKQJBMYLO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-(4-(tert-butyl)benzyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
CAS: 333415-38-6
CID: 590142
Formula: C18H22N4O2
MW: 326.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight326.4
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass326.17427596
Monoisotopic Mass326.17427596
Topological Polar Surface Area58.4 Ų
Heavy Atom Count24
Formal Charge0
Complexity508
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

Alternative Products

CatalogName
BA6900-10VU0071063

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