Products for Research Use Only

ABT-670

CAT: 0013-GTR19204107-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204107-01Size:25 mg
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Description
ABT-670 is a selective dopamine D4 receptor agonist, exhibiting EC50 values of 89 nM (human), 160 nM (ferret), and 93 nM (rat) . This compound is a valuable research tool for investigating D4 receptor function in neuropsychiatric disorders through in vitro assays and behavioral studies.
CAS Number
630119-43-6
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
O=N=1C (C2CCN (CNC (=O) C3=CC (C) =CC=C3) CC2) =CC=CC1
Molecular Formula
C19H23N3O2
Molecular Weight
325.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-Methyl-n-(1-oxy-3',4',5',6'-tetrahydro-2'h-(2,4'-bipyridine)-1'-ylmethyl)benzamide
CAS Number630119-43-6
PubChem CID16094676
IUPAC Name3-methyl-N-[[4-(1-oxidopyridin-1-ium-2-yl)piperidin-1-yl]methyl]benzamide
Molecular FormulaC19H23N3O2
Molecular Weight325.4
XLogP1.9
Topological Polar Surface Area57.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity409
SMILES
CC1=CC(=CC=C1)C(=O)NCN2CCC(CC2)C3=CC=CC=[N+]3[O-]
InChI
InChI=1S/C19H23N3O2/c1-15-5-4-6-17(13-15)19(23)20-14-21-11-8-16(9-12-21)18-7-2-3-10-22(18)24/h2-7,10,13,16H,8-9,11-12,14H2,1H3,(H,20,23)
InChIKey
PUMMPCXNEPHBNN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methyl-n-(1-oxy-3',4',5',6'-tetrahydro-2'h-(2,4'-bipyridine)-1'-ylmethyl)benzamide
CAS: 630119-43-6
CID: 16094676
Formula: C19H23N3O2
MW: 325.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight325.4
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass325.17902698
Monoisotopic Mass325.17902698
Topological Polar Surface Area57.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity409
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