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YM-244769

CAT: 0013-GTR19166710-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19166710-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
YM-244769
CAS Number
838819-70-8
Product Name Alternative
SH-SY5Y cells, YM 244769, YM244769, YM-244769, CalciumChannel, Calcium Channel, anti-ischemic, 3-Pyridinecarboxamide, N-[ (3-aminophenyl) methyl]-6-[4-[ (3-fluorophenyl) methoxy]phenoxy]-, inhibit, LLC-PK1 cells, nicotinamide, neuroprotective, Na+/Ca2+ exchange, Na+/Ca2+ Exchanger, NCX3, Inhibitor
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Purity
95.62% (May vary between batches)
Solubility
DMSO:245 mg/mL (552.46 mM) ;10% DMSO+90% Corn Oil:3.3 mg/mL (7.44 mM)
Smiles
Nc1cccc (CNC (=O) c2ccc (Oc3ccc (OCc4cccc (F) c4) cc3) nc2) c1
Molecular Formula
C26H22FN3O3
Molecular Weight
443.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

YM-244769
CAS Number838819-70-8
PubChem CID11442117
IUPAC NameN-[(3-aminophenyl)methyl]-6-[4-[(3-fluorophenyl)methoxy]phenoxy]pyridine-3-carboxamide
Molecular FormulaC26H22FN3O3
Molecular Weight443.5
XLogP4.4
Topological Polar Surface Area86.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count33
Formal Charge0
Complexity601
SMILES
C1=CC(=CC(=C1)N)CNC(=O)C2=CN=C(C=C2)OC3=CC=C(C=C3)OCC4=CC(=CC=C4)F
InChI
InChI=1S/C26H22FN3O3/c27-21-5-1-4-19(13-21)17-32-23-8-10-24(11-9-23)33-25-12-7-20(16-29-25)26(31)30-15-18-3-2-6-22(28)14-18/h1-14,16H,15,17,28H2,(H,30,31)
InChIKey
JZMLHJRKSJXARY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of YM-244769
CAS: 838819-70-8
CID: 11442117
Formula: C26H22FN3O3
MW: 443.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight443.5
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass443.16451973
Monoisotopic Mass443.16451973
Topological Polar Surface Area86.5 Ų
Heavy Atom Count33
Formal Charge0
Complexity601
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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