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Maprotiline-d5 Hydrochloride

CAT: 0931-TMID-0207-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TMID-0207-01Size:1 mg
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CAS Number
1794942-12-3
Target
Autophagy
Related Pathways
Autophagy
Bioactivity
Maprotiline-d5 Hydrochloride is a deuterated compound of Maprotiline Hydrochloride. Maprotiline Hydrochloride has a CAS number of 10347-81-6. Maprotiline hydrochloride is a bridged-ring tetracyclic antidepressant that is both mechanistically and functionally similar to the tricyclic antidepressants, including side effects associated with its use.
Smiles
C(CC(NC([2H])([2H])[2H])([2H])[2H])C12C=3C(C(C=4C1=CC=CC4)CC2)=CC=CC3.Cl
Molecular Formula
C20H19D5ClN
Molecular Weight
318.9
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Maprotiline-d5 Hydrochloride
CAS Number1794942-12-3
PubChem CID71749906
IUPAC Name1,1-dideuterio-3-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-N-(trideuteriomethyl)propan-1-amine;hydrochloride
Molecular FormulaC20H24ClN
Molecular Weight318.9
Topological Polar Surface Area12
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity339
SMILES
[2H]C([2H])([2H])NC([2H])([2H])CCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24.Cl
InChI
InChI=1S/C20H23N.ClH/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20;/h2-5,7-10,15,21H,6,11-14H2,1H3;1H/i1D3,14D2;
InChIKey
NZDMFGKECODQRY-QHZJUOFTSA-N
Chemical Structure
2D Structure
2D structure of Maprotiline-d5 Hydrochloride
CAS: 1794942-12-3
CID: 71749906
Formula: C20H24ClN
MW: 318.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight318.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass318.1911112
Monoisotopic Mass318.1911112
Topological Polar Surface Area12 Ų
Heavy Atom Count22
Formal Charge0
Complexity339
Isotope Atom Count5
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes