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Chemical structure of Tandospirone citrate

GC37734

Tandospirone citrate

Also known as 2-hydroxypropane-1,2,3-tricarboxylic acid;(1R,2S,6R,7S)-4-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione

Tandospirone citrate is a potent and selective 5-HT1A receptor partial agonist (Ki = 27 nM) that displays selectivity over SR-2, SR-1C, α1, α2, D1 and D2 receptors (Ki values ranging from 1300-41000 nM)

ChemicalCAS112457-95-1MW575.61FormulaC27H37N5O9
CAS number
112457-95-1
Molecular weight
575.61
Formula
C27H37N5O9
Solubility
Water： 10·4 mg/mL (18·07 mM)
InChIKey
DMLGUJHNIWGCKM-DPFKZJTMSA-N
Catalogue number
GC37734
Brand
GLPBIO
Computed properties PubChem CID 60558 · TPSA 202 Ų · H-bond donors 4 · H-bond acceptors 13
TPSA
202 Ų
H-bond donors
4
H-bond acceptors
13
Rotatable bonds
11
Heavy atoms
41

SMILES C1C[C@H]2C[C@@H]1[C@H]3[C@@H]2C(=O)N(C3=O)CCCCN4CCN(CC4)C5=NC=CC=N5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Computed descriptors from PubChem (CID 60558), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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