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Chemical structure of NRA-0160

GC31015

NRA-0160

Also known as 4-(4-fluorophenyl)-5-[2-[4-[(3-fluorophenyl)methylidene]piperidin-1-yl]ethyl]-1,3-thiazole-2-carboxamide

NRA-0160 is a selective dopamine D4 receptor antagonist, with a Ki value of 0·48 nM and with negligible affinity for dopamine D2 receptor (Ki: >10000 nM), D3 receptor (Ki: 39 nM), rat 5-HT2A receptor (Ki: 180 nM) and rat α1 adrenoceptor (Ki: 237 nM)

ChemicalCAS204718-47-8MW439.52FormulaC24H23F2N3OS
CAS number
204718-47-8
Molecular weight
439.52
Formula
C24H23F2N3OS
Solubility
Soluble in DMSO
InChIKey
QESXTNJNPLVEOR-UHFFFAOYSA-N
Catalogue number
GC31015
Brand
GLPBIO
Computed properties PubChem CID 10433314 · XLogP 4.6 · TPSA 87.5 Ų · H-bond donors 1
XLogP
4.6
TPSA
87.5 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
31

SMILES C1CN(CCC1=CC2=CC(=CC=C2)F)CCC3=C(N=C(S3)C(=O)N)C4=CC=C(C=C4)F

Computed descriptors from PubChem (CID 10433314), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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