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1021868-80-3

1021868-80-3 Structure

1021868-80-3 Structure
IdentificationBack Directory
[Name]

(+/-)-3-[(4-IODOPHENYL)-1-PIPERAZYL] METHYLPYRROLO [2,3-B] PYRIMIDINE TRIHYDROCHLORIDE
[CAS]

1021868-80-3
[Synonyms]

667
L750
L-750
L 750
667 TriHydrochloride
L-750,667 TRIHYDROCHLORIDE
L-750,667 trihydrochloride solid
L750,667 TriHydrochloride,L 750,667 TriHydrochloride
3-[4-(4-Iodophenyl)piperazin-1-yl]methyl-1H-pyrrolo[2,3-b]pyridine trihydrochloride
(+/-)-3-[(4-IODOPHENYL)-1-PIPERAZYL] METHYLPYRROLO [2,3-B] PYRIMIDINE TRIHYDROCHLORIDE
[Molecular Formula]

C18H22Cl3IN4
[MDL Number]

MFCD20486793
[MOL File]

1021868-80-3.mol
[Molecular Weight]

527.66
Chemical PropertiesBack Directory
[storage temp. ]

2-8°C
[solubility ]

ethanol: 10 mg/mL
[form ]

solid
[color ]

white
[Water Solubility ]

H2O: ≥12mg/mL
[InChI]

1S/C18H19IN4.3ClH/c19-15-3-5-16(6-4-15)23-10-8-22(9-11-23)13-14-12-21-18-17(14)2-1-7-20-18;;;/h1-7,12H,8-11,13H2,(H,20,21);3*1H
[InChIKey]

YOURSPNOEWYAKO-UHFFFAOYSA-N
[SMILES]

Cl.Cl.Cl.Ic1ccc(cc1)N2CCN(CC2)Cc3c[nH]c4ncccc34
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

Useful in characterizing the extracellular domain of the D4 dopamine receptor.
[Biological Activity]

Selective D4 dopamine receptor antagonist.
[IC 50]

D4 Receptor: 0.51 nM (Ki); D4 Receptor: 0.16 nM (Kd)
Spectrum DetailBack Directory
[Spectrum Detail]

(+/-)-3-[(4-IODOPHENYL)-1-PIPERAZYL] METHYLPYRROLO [2,3-B] PYRIMIDINE TRIHYDROCHLORIDE(1021868-80-3)1HNMR
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