Products for Research Use Only

MAO-B-IN-19

CAT: 0931-T80634-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T80634-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
152897-41-1
Target
Monoamine Oxidase
Related Pathways
Neuroscience
Bioactivity
MAO-B-IN-19, a selective MAO-B inhibitor, exhibits neuroprotective and anti-inflammatory properties and demonstrates an IC50 value of 0.67 μM [1].
Smiles
OC1=C(C=CC=C1)C(=O)\C=C\C1=CC=C(F)C=C1
Molecular Formula
C15H11FO2
Molecular Weight
242.25
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(E)-3-(4-fluorophenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one
CAS Number152897-41-1
PubChem CID5337942
IUPAC Name(E)-3-(4-fluorophenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one
Molecular FormulaC15H11FO2
Molecular Weight242.24
XLogP4
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity306
SMILES
C1=CC=C(C(=C1)C(=O)/C=C/C2=CC=C(C=C2)F)O
InChI
InChI=1S/C15H11FO2/c16-12-8-5-11(6-9-12)7-10-15(18)13-3-1-2-4-14(13)17/h1-10,17H/b10-7+
InChIKey
BGVXUADKPAJQBF-JXMROGBWSA-N
Chemical Structure
2D Structure
2D structure of (E)-3-(4-fluorophenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one
CAS: 152897-41-1
CID: 5337942
Formula: C15H11FO2
MW: 242.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight242.24
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass242.07430775
Monoisotopic Mass242.07430775
Topological Polar Surface Area37.3 Ų
Heavy Atom Count18
Formal Charge0
Complexity306
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes