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Ko-3290

CAT: 0931-T11763-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T11763-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
79848-61-6
Target
Others, Adrenergic Receptor
Related Pathways
GPCR/G Protein, Neuroscience, Others
Bioactivity
Ko-3290 is a cardioselective antagonist of β-adrenoceptors known for its antilipolytic effects in animals.
Smiles
O(CC(CNC(C#C)(C)C)O)C1=C(C#N)C=C(NC(C(C)C)=O)C=C1
Molecular Formula
C19H25N3O3
Molecular Weight
343.42
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Koe 3290
CAS Number79848-61-6
PubChem CID3036168
IUPAC NameN-[3-cyano-4-[2-hydroxy-3-(2-methylbut-3-yn-2-ylamino)propoxy]phenyl]-2-methylpropanamide
Molecular FormulaC19H25N3O3
Molecular Weight343.4
XLogP1.5
Topological Polar Surface Area94.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count25
Formal Charge0
Complexity541
SMILES
CC(C)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C#C)O)C#N
InChI
InChI=1S/C19H25N3O3/c1-6-19(4,5)21-11-16(23)12-25-17-8-7-15(9-14(17)10-20)22-18(24)13(2)3/h1,7-9,13,16,21,23H,11-12H2,2-5H3,(H,22,24)
InChIKey
OPEGAEBRVGIBAS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Koe 3290
CAS: 79848-61-6
CID: 3036168
Formula: C19H25N3O3
MW: 343.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight343.4
XLogP31.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass343.18959167
Monoisotopic Mass343.18959167
Topological Polar Surface Area94.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity541
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes