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Opc 8490

CAT: 1410-M34673-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M34673-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Opc 8490 is a cardiotonic agent and a positive inotropic vasodilator that increases Ca current (ICa) in a dose-dependent and reversible manner and prolongs atrial action potential in a concentration-dependent manner.
CAS Number
123941-50-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
597.61
Molecular Formula
C30H35N3O10
Notes
Research use only, not for human use.
Receptor
Calcium Channel

Chemical Information

2(1H)-Quinolinone, 3,4-dihydro-6-((4-(4-oxo-4-phenylbutyl)-1-piperazinyl)carbonyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)

structure given in first source

CAS Number123941-50-4
PubChem CID3035953
IUPAC Name2-hydroxypropane-1,2,3-tricarboxylic acid;6-[4-(4-oxo-4-phenylbutyl)piperazine-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one
Molecular FormulaC30H35N3O10
Molecular Weight597.6
Topological Polar Surface Area202
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count11
Heavy Atom Count43
Formal Charge0
Complexity851
SMILES
C1CC(=O)NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)CCCC(=O)C4=CC=CC=C4.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
InChI
InChI=1S/C24H27N3O3.C6H8O7/c28-22(18-5-2-1-3-6-18)7-4-12-26-13-15-27(16-14-26)24(30)20-8-10-21-19(17-20)9-11-23(29)25-21;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-3,5-6,8,10,17H,4,7,9,11-16H2,(H,25,29);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey
ONELTIQETCJUSG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2(1H)-Quinolinone, 3,4-dihydro-6-((4-(4-oxo-4-phenylbutyl)-1-piperazinyl)carbonyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
CAS: 123941-50-4
CID: 3035953
Formula: C30H35N3O10
MW: 597.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight597.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count11
Exact Mass597.23224432
Monoisotopic Mass597.23224432
Topological Polar Surface Area202 Ų
Heavy Atom Count43
Formal Charge0
Complexity851
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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