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Letimide HCl

CAT: 0931-T25673-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T25673-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
21791-39-9
Target
Endogenous Metabolite, Others
Related Pathways
Metabolism, Others
Bioactivity
Letimide HCl is an analgesic agent.
Smiles
Cl.O=C1OC=2C=CC=CC2C(=O)N1CCN(CC)CC
Molecular Formula
C14H19ClN2O3
Molecular Weight
298.77
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Letimide Hydrochloride
CAS Number21791-39-9
PubChem CID172992
IUPAC Name3-[2-(diethylamino)ethyl]-1,3-benzoxazine-2,4-dione;hydrochloride
Molecular FormulaC14H19ClN2O3
Molecular Weight298.76
Topological Polar Surface Area49.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity342
SMILES
CCN(CC)CCN1C(=O)C2=CC=CC=C2OC1=O.Cl
InChI
InChI=1S/C14H18N2O3.ClH/c1-3-15(4-2)9-10-16-13(17)11-7-5-6-8-12(11)19-14(16)18;/h5-8H,3-4,9-10H2,1-2H3;1H
InChIKey
QPFDPUCWRFYCFB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Letimide Hydrochloride
CAS: 21791-39-9
CID: 172992
Formula: C14H19ClN2O3
MW: 298.76
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight298.76
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass298.1084202
Monoisotopic Mass298.1084202
Topological Polar Surface Area49.9 Ų
Heavy Atom Count20
Formal Charge0
Complexity342
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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GTR19199007-01Letimide HCl
HY-105578ALetimide (hydrochloride)

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