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Org 6582

CAT: 0013-GTR19210903-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210903-03Size:100 mg
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Description
Org 6582 is a selective serotonin reuptake inhibitor (SSRI) for research use. It is a valuable tool for investigating serotonergic neurotransmission in both in vitro binding assays and in vivo models of depression and anxiety-related behaviors.
CAS Number
59905-71-4
Smiles
Cl.[H][C@]12Cc3cc (Cl) ccc3[C@] ([H]) (CC=C1) [C@@H]2N
Molecular Formula
C13H15Cl2N
Molecular Weight
256.17
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Org 6582

inhibits 3-hydroxytryptamine reuptake; RN & NM refer to HCl

CAS Number59905-71-4
PubChem CID133082267
IUPAC Name(1S,9S,13R)-5-chlorotricyclo[7.3.1.02,7]trideca-2(7),3,5,10-tetraen-13-amine;hydrochloride
Molecular FormulaC13H15Cl2N
Molecular Weight256.17
Topological Polar Surface Area26
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count16
Formal Charge0
Complexity276
SMILES
C1C=C[C@@H]2CC3=C([C@H]1[C@@H]2N)C=CC(=C3)Cl.Cl
InChI
InChI=1S/C13H14ClN.ClH/c14-10-4-5-11-9(7-10)6-8-2-1-3-12(11)13(8)15;/h1-2,4-5,7-8,12-13H,3,6,15H2;1H/t8-,12+,13-;/m1./s1
InChIKey
LWRJZIPAGMGXQJ-POJHVLMBSA-N
Chemical Structure
2D Structure
2D structure of Org 6582
CAS: 59905-71-4
CID: 133082267
Formula: C13H15Cl2N
MW: 256.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.17
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass255.0581549
Monoisotopic Mass255.0581549
Topological Polar Surface Area26 Ų
Heavy Atom Count16
Formal Charge0
Complexity276
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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