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LUF7244

CAT: 0013-GTR19187125-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19187125-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
LUF7244
CAS Number
1821638-43-0
Field of Research
Pharmacology & Drug Discovery
Smiles
C (=O) (C1=CC=C (OCC (NC=2C=CC=NC2) =O) C=C1) C3=CC (Cl) =CC=C3
Molecular Formula
C20H15ClN2O3
Molecular Weight
366.8
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Luf7244

allosteric modulator-activator of K v 11.1 channels

CAS Number1821638-43-0
PubChem CID127042386
IUPAC Name2-[4-(3-chlorobenzoyl)phenoxy]-N-pyridin-3-ylacetamide
Molecular FormulaC20H15ClN2O3
Molecular Weight366.8
XLogP3.7
Topological Polar Surface Area68.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity480
SMILES
C1=CC(=CC(=C1)Cl)C(=O)C2=CC=C(C=C2)OCC(=O)NC3=CN=CC=C3
InChI
InChI=1S/C20H15ClN2O3/c21-16-4-1-3-15(11-16)20(25)14-6-8-18(9-7-14)26-13-19(24)23-17-5-2-10-22-12-17/h1-12H,13H2,(H,23,24)
InChIKey
KKKJYDOHVKIIQP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Luf7244
CAS: 1821638-43-0
CID: 127042386
Formula: C20H15ClN2O3
MW: 366.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight366.8
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass366.0771200
Monoisotopic Mass366.0771200
Topological Polar Surface Area68.3 Ų
Heavy Atom Count26
Formal Charge0
Complexity480
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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