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Atomoxetine

CAT: 1410-M16079-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M16079-02Size:5 mg
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Description
Atomoxetine ((R) -Tomoxetine; LY-139603) is a potent, selective norepinephrine (NE) transporter inhibitor with Ki of 5 nM.
CAS Number
83015-26-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
255.361
Molecular Formula
C17H21NO
Notes
Research use only, not for human use.
Receptor
Monoamine Transporter

Chemical Information

Atomoxetine

Atomoxetine is a secondary amino compound having methyl and 3-(2-methylphenoxy)-3-phenylpropan-1-yl substituents. It has a role as an antidepressant, an adrenergic uptake inhibitor, a xenobiotic and an environmental contaminant. It is a member of toluenes, an aromatic ether and a secondary amino compound.

CAS Number83015-26-3
PubChem CID54841
IUPAC Name(3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine
Molecular FormulaC17H21NO
Molecular Weight255.35
XLogP3.7
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count19
Formal Charge0
Complexity237
SMILES
CC1=CC=CC=C1O[C@H](CCNC)C2=CC=CC=C2
InChI
InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1
InChIKey
VHGCDTVCOLNTBX-QGZVFWFLSA-N
Chemical Structure
2D Structure
2D structure of Atomoxetine
CAS: 83015-26-3
CID: 54841
Formula: C17H21NO
MW: 255.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight255.35
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass255.162314293
Monoisotopic Mass255.162314293
Topological Polar Surface Area21.3 Ų
Heavy Atom Count19
Formal Charge0
Complexity237
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3606077-01Atomoxetine
RM-A150911-01Atomoxetine USP Rc Desmethyl Atomoxetine
B2244-5.1Atomoxetine HCl
CS-O-03641Atomoxetine-d7
HY-17385-01Atomoxetine (hydrochloride)
HY-107370S1Atomoxetine-d5
MBS3606055-01Atomoxetine hydrochloride
TRC-D297510-25MGDestolyl Atomoxetine
CS-ED-01074Desmethyl atomoxetine

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