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MAO-B-IN-15

CAT: 0931-T60573-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T60573-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2032436-79-4
Target
Others, Monoamine Oxidase
Related Pathways
Others, Neuroscience
Bioactivity
MAO-B-IN-15 is a selective MAO-B inhibitor (IC50 = 13.5 μM) that forms π-π interactions with the Tyr 326 residue, and it can be utilized in Parkinson's disease research[1].
Smiles
O(C)C=1C=C2C(=CC1OC)CCN(C2)C3=CC=C(F)C=C3
Molecular Formula
C17H18FNO2
Molecular Weight
287.33
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Mao-B-IN-15
CAS Number2032436-79-4
PubChem CID165412602
IUPAC Name2-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline
Molecular FormulaC17H18FNO2
Molecular Weight287.33
XLogP3.6
Topological Polar Surface Area21.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity333
SMILES
COC1=C(C=C2CN(CCC2=C1)C3=CC=C(C=C3)F)OC
InChI
InChI=1S/C17H18FNO2/c1-20-16-9-12-7-8-19(11-13(12)10-17(16)21-2)15-5-3-14(18)4-6-15/h3-6,9-10H,7-8,11H2,1-2H3
InChIKey
JAINUECTMBLRLL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mao-B-IN-15
CAS: 2032436-79-4
CID: 165412602
Formula: C17H18FNO2
MW: 287.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight287.33
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass287.13215698
Monoisotopic Mass287.13215698
Topological Polar Surface Area21.7 Ų
Heavy Atom Count21
Formal Charge0
Complexity333
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-151209MAO-B-IN-15
B2919-5MAO-A/MAO-B Inhibitor
YP-W19977-01Human MAO-B (MAO-B) ELISA Kit
YP-W200865-01Mouse MAO-B (MAO-B) ELISA Kit
YP-W35915-01Rat MAO-B (MAO-B) ELISA Kit
sc-515575MAO-B (B-8)
BA8520-25MAO-B-IN-2
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HY-175523MAO-B-IN-48

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