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Duloxetine-d3 HCl

CAT: 0931-TMIH-0205-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TMIH-0205-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1188266-11-6
Bioactivity
Duloxetine-d3 HCl is a deuterated compound of Duloxetine HCl. Duloxetine HCl has a CAS number of 136434-34-9. Duloxetine hydrochloride is a thiophene derivative and selective neurotransmitter uptake inhibitor for SEROTONIN and NORADRENALINE (SNRI) . It is an ANTIDEPRESSIVE AGENT and ANXIOLYTIC and is also used for the treatment of pain in patients with DIABETES MELLITUS and FIBROMYALGIA.
Smiles
Cl.[2H]C([2H])([2H])NCCC(OC1=CC=CC2=C1C=CC=C2)C1=CC=CS1
Molecular Formula
C18H17D3ClNOS
Molecular Weight
336.89
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(methyl-d3)-3-(naphthalen-1-yloxy)-3-(thiophen-2-yl)propan-1-amine,monohydrochloride
CAS Number1188266-11-6
PubChem CID45358977
IUPAC Name3-naphthalen-1-yloxy-3-thiophen-2-yl-N-(trideuteriomethyl)propan-1-amine;hydrochloride
Molecular FormulaC18H20ClNOS
Molecular Weight336.9
Topological Polar Surface Area49.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity312
SMILES
[2H]C([2H])([2H])NCCC(C1=CC=CS1)OC2=CC=CC3=CC=CC=C32.Cl
InChI
InChI=1S/C18H19NOS.ClH/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16;/h2-10,13,17,19H,11-12H2,1H3;1H/i1D3;
InChIKey
BFFSMCNJSOPUAY-NIIDSAIPSA-N
Chemical Structure
2D Structure
2D structure of N-(methyl-d3)-3-(naphthalen-1-yloxy)-3-(thiophen-2-yl)propan-1-amine,monohydrochloride
CAS: 1188266-11-6
CID: 45358977
Formula: C18H20ClNOS
MW: 336.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight336.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass336.1142434
Monoisotopic Mass336.1142434
Topological Polar Surface Area49.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity312
Isotope Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
CS-EO-02520Duloxetine-d3
CS-O-63336Rac-Duloxetine-d3
CS-O-20075Duloxetine-d3 Hydrochloride
HY-B0161AS-01Duloxetine-d3 (hydrochloride)
447746Duloxetine-d3 Oxalate
447745Duloxetine-d3 Maleate
HY-B0161ES-01(±) -Duloxetine-d3 (hydrochloride)
MBS5766543Duloxetine D3 hydrochloride
ESS0330-01Rac-Duloxetine-D3 Oxalate
4366625-Hydroxy Duloxetine-d3

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