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SEN177

CAT: 0931-T61063-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T61063-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2117405-13-5
Target
Huntingtin, Apoptosis, Beta Amyloid, Glutaminyl Cyclase
Related Pathways
Neuroscience, Apoptosis
Bioactivity
SEN177 shows the potential in the research of Huntington's disease that is a potent inhibitor of glutaminyl cyclase (QPCT) with an IC 50 of 0.013μM for glutaminyl-peptide cyclotransferase-like (QPCTL) . The Ki value of SEN177 for human glutaminyl cyclase (hQC) is 20 nM. SEN177 significantly reduces the early stages of mutant HTT oligomerisation and reduces the percentage of neurons with Q80 aggregates [1].
Smiles
Cn1cnnc1C1CCN(CC1)c1ncccc1-c1ccc(F)nc1
Molecular Formula
C18H19FN6
Molecular Weight
338.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-(6-fluoropyridin-3-yl)-2-(4-(4-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl)pyridine

SEN177 is a member of bipyridines.

CAS Number2117405-13-5
PubChem CID91618245
IUPAC Name2-fluoro-5-[2-[4-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-3-pyridinyl]pyridine
Molecular FormulaC18H19FN6
Molecular Weight338.4
XLogP2.1
Topological Polar Surface Area59.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity430
SMILES
CN1C=NN=C1C2CCN(CC2)C3=C(C=CC=N3)C4=CN=C(C=C4)F
InChI
InChI=1S/C18H19FN6/c1-24-12-22-23-17(24)13-6-9-25(10-7-13)18-15(3-2-8-20-18)14-4-5-16(19)21-11-14/h2-5,8,11-13H,6-7,9-10H2,1H3
InChIKey
AJIAMIPUWJQSPR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(6-fluoropyridin-3-yl)-2-(4-(4-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl)pyridine
CAS: 2117405-13-5
CID: 91618245
Formula: C18H19FN6
MW: 338.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight338.4
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass338.16552279
Monoisotopic Mass338.16552279
Topological Polar Surface Area59.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity430
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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CatalogName
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