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Tandamine

CAT: 0013-GTR19241982-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19241982-02Size:50 mg
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Description
Tandamine is a selective serotonin reuptake inhibitor (SSRI) developed for depression research. It is utilized in both in vitro binding assays and in vivo behavioral studies to investigate serotonergic neurotransmission and antidepressant mechanisms.
CAS Number
42408-80-0
Smiles
S1CCC=2C=3C=CC=CC3N (C2C1 (C) CCN (C) C) CC
Molecular Formula
C18H26N2S
Molecular Weight
302.48
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tandamine

Tandamine was researched in 1970s as an antidepressant but was never commercialized. Tandamine is an analog of pirandamine and it acts as a selective serotonin reuptake inhibitor (SSRI).

CAS Number42408-80-0
PubChem CID39187
IUPAC Name2-(9-ethyl-1-methyl-3,4-dihydrothiopyrano[3,4-b]indol-1-yl)-N,N-dimethylethanamine
Molecular FormulaC18H26N2S
Molecular Weight302.5
XLogP3.4
Topological Polar Surface Area33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity359
SMILES
CCN1C2=CC=CC=C2C3=C1C(SCC3)(C)CCN(C)C
InChI
InChI=1S/C18H26N2S/c1-5-20-16-9-7-6-8-14(16)15-10-13-21-18(2,17(15)20)11-12-19(3)4/h6-9H,5,10-13H2,1-4H3
InChIKey
BRPOADLGOFPKKJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tandamine
CAS: 42408-80-0
CID: 39187
Formula: C18H26N2S
MW: 302.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight302.5
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass302.18167001
Monoisotopic Mass302.18167001
Topological Polar Surface Area33.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity359
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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