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Chemical structure of 5-HT3 antagonist 2

GC31247

5-HT3 antagonist 2

Also known as 2'-(1-methylindol-3-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]

5-HT3 antagonist 2 is a 5-HT3 receptor antagonist

ChemicalCAS128199-93-9MW295.38FormulaC18H21N3O
CAS number
128199-93-9
Molecular weight
295.38
Formula
C18H21N3O
Solubility
Soluble in DMSO
InChIKey
GJZYDYYJSGXPCE-UHFFFAOYSA-N
Catalogue number
GC31247
Brand
GLPBIO
Computed properties PubChem CID 9904233 · XLogP 2 · TPSA 29.8 Ų · H-bond donors 0
XLogP
2
TPSA
29.8 Ų
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
22

SMILES CN1C=C(C2=CC=CC=C21)C3=NCC4(O3)CN5CCC4CC5

Computed descriptors from PubChem (CID 9904233), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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