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EB-42486

CAT: 1410-M28245-05Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M28245-05Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
EB-42486 is an effective and highly selective inhibitor of G2019S-LRRK2 with an IC50 < 0.2 nM.
CAS Number
2390475-81-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
414.46
Molecular Formula
C22H22N8O
Notes
Research use only, not for human use.
Receptor
Human Endogenous Metabolite|VD2

Chemical Information

4,5,7,7-Tetramethyl-N-(3-phenyl-1H-indazol-5-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
CAS Number2390475-81-5
PubChem CID155925851
IUPAC Name4,5,7,7-tetramethyl-N-(3-phenyl-1H-indazol-5-yl)tetrazolo[1,5-a]pyrimidine-6-carboxamide
Molecular FormulaC22H22N8O
Molecular Weight414.5
XLogP2.9
Topological Polar Surface Area105
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count31
Formal Charge0
Complexity733
SMILES
CC1=C(C(N2C(=NN=N2)N1C)(C)C)C(=O)NC3=CC4=C(C=C3)NN=C4C5=CC=CC=C5
InChI
InChI=1S/C22H22N8O/c1-13-18(22(2,3)30-21(29(13)4)26-27-28-30)20(31)23-15-10-11-17-16(12-15)19(25-24-17)14-8-6-5-7-9-14/h5-12H,1-4H3,(H,23,31)(H,24,25)
InChIKey
KHSAHYKLUPESPP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,5,7,7-Tetramethyl-N-(3-phenyl-1H-indazol-5-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
CAS: 2390475-81-5
CID: 155925851
Formula: C22H22N8O
MW: 414.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight414.5
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass414.19165736
Monoisotopic Mass414.19165736
Topological Polar Surface Area105 Ų
Heavy Atom Count31
Formal Charge0
Complexity733
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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