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PFE-360

CAT: 0931-T16512-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T16512-04Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1527475-61-1
Target
LRRK2
Related Pathways
Autophagy
Purity
0.9991
Bioactivity
PFE-360 (PF-06685360) is a potent and selective inhibitor of LRRK2 kinase, with an in vivo IC50 of 2.3 nM.
Smiles
Cn1cc(cc1C#N)-c1c[nH]c2ncnc(N3CCOCC3)c12
Molecular Formula
C16H16N6O
Molecular Weight
308.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-methyl-4-(4-morpholin-4-yl-7H-pyrrolo(2,3-d)pyrimidin-5-yl)pyrrole-2-carbonitrile
CAS Number1527475-61-1
PubChem CID89915073
IUPAC Name1-methyl-4-(4-morpholin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrrole-2-carbonitrile
Molecular FormulaC16H16N6O
Molecular Weight308.34
XLogP1.2
Topological Polar Surface Area82.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity472
SMILES
CN1C=C(C=C1C#N)C2=CNC3=C2C(=NC=N3)N4CCOCC4
InChI
InChI=1S/C16H16N6O/c1-21-9-11(6-12(21)7-17)13-8-18-15-14(13)16(20-10-19-15)22-2-4-23-5-3-22/h6,8-10H,2-5H2,1H3,(H,18,19,20)
InChIKey
IYQTYHISVSPMSU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-methyl-4-(4-morpholin-4-yl-7H-pyrrolo(2,3-d)pyrimidin-5-yl)pyrrole-2-carbonitrile
CAS: 1527475-61-1
CID: 89915073
Formula: C16H16N6O
MW: 308.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight308.34
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass308.13855916
Monoisotopic Mass308.13855916
Topological Polar Surface Area82.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity472
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
BA3685-5.1PFE-360
MBS3843276-01PFE-360 (PF-06685360)
A18816-25PFE-360 (PF-06685360) 25mg
A18816-2PFE-360 (PF-06685360) 2mg
A18816-100PFE-360 (PF-06685360) 100mg
A18816-50PFE-360 (PF-06685360) 50mg
A18816-10PFE-360 (PF-06685360) 10mg
A18816-5PFE-360 (PF-06685360) 5mg
A18816-500PFE-360 (PF-06685360) 500mg
A18816-1PFE-360 (PF-06685360) 1mg

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