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Chemical structure of Flesinoxan

GC60846

Flesinoxan

Also known as 4-fluoro-N-[2-[4-[(2S)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-5-yl]piperazin-1-yl]ethyl]benzamide

Flesinoxan is a hypotensive agent and a potent, high affinity and selective 5-hydroxytryptamine1A (5-HT1A) receptor agonist with an EC50 value of 24 nM

ChemicalCAS98206-10-1MW415.46FormulaC22H26FN3O4
CAS number
98206-10-1
Molecular weight
415.46
Formula
C22H26FN3O4
Solubility
DMSO： 31·25 mg/mL (75·22 mM)
InChIKey
NYSDRDDQELAVKP-SFHVURJKSA-N
Catalogue number
GC60846
Brand
GLPBIO
Computed properties PubChem CID 57347 · XLogP 2 · TPSA 74.3 Ų · H-bond donors 2
XLogP
2
TPSA
74.3 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
30

SMILES C1CN(CCN1CCNC(=O)C2=CC=C(C=C2)F)C3=C4C(=CC=C3)O[C@H](CO4)CO

Computed descriptors from PubChem (CID 57347), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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