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Chemical structure of DU125530

GB40186

DU125530

Also known as 2-[4-[4-(7-chloro-2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]butyl]-1,1-dioxo-1,2-benzothiazol-3-one

DU125530 is a selective 5-HT1A receptor antagonist (Ki value of 0·7 nM)· DU-125530 showed equal (low nM) potency to displace agonist and antagonist binding to pre- and post-synaptic 5-HT1A receptors in rat and human brain

ChemicalCAS161611-99-0MW491.99FormulaC23H26ClN3O5S
CAS number
161611-99-0
Molecular weight
491.99
Formula
C23H26ClN3O5S
InChIKey
LYXKFNHUJJDTIA-UHFFFAOYSA-N
Catalogue number
GB40186
Brand
GLPBIO
Computed properties PubChem CID 9848499 · XLogP 3.3 · TPSA 87.8 Ų · H-bond donors 0
XLogP
3.3
TPSA
87.8 Ų
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
33

SMILES C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C4=C5C(=CC(=C4)Cl)OCCO5

Computed descriptors from PubChem (CID 9848499), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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