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Merck
CN

G5793

GR 127935 hydrochloride hydrate

>98% (HPLC), powder

Synonym(s):

N-[4-Methoxy-3-(4-methyl-1-piperazinyl)phenyl]-2´-methyl-4´-(5-methyl-1,2,4-oxadiazol-3-yl)-1,1´-biphenyl-4-carboxamide hydrochloride hydrate

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About This Item

Empirical Formula (Hill Notation):
C29H31N5O3 · HCl · xH2O
CAS Number:
148642-42-6
Molecular Weight:
534.05 (anhydrous basis)
NACRES:
NA.77
PubChem Substance ID:
24278688
UNSPSC Code:
12352200
MDL number:
MFCD11045922

Key Documents

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Product Name

GR 127935 hydrochloride hydrate, >98% (HPLC), powder

InChI key

KSXUSAQPMSACQS-UHFFFAOYSA-N

SMILES string

O.Cl.COc1ccc(NC(=O)c2ccc(cc2)-c3ccc(cc3C)-c4noc(C)n4)cc1N5CCN(C)CC5

InChI

1S/C29H31N5O3.ClH.H2O/c1-19-17-23(28-30-20(2)37-32-28)9-11-25(19)21-5-7-22(8-6-21)29(35)31-24-10-12-27(36-4)26(18-24)34-15-13-33(3)14-16-34;;/h5-12,17-18H,13-16H2,1-4H3,(H,31,35);1H;1H2

assay

>98% (HPLC)

form

powder

storage condition

desiccated

color

white to beige

solubility

DMSO: 10 mg/mL, clear

originator

GlaxoSmithKline

storage temp.

2-8°C

Quality Level

100

Gene Information

human ... HTR1B(3351), HTR1D(3352)

Biochem/physiol Actions

Potent, selective and orally active 5-HT1B/1D serotonin receptor antagonist.

Disclaimer

Desiccate

Features and Benefits

This compound was developed by GlaxoSmithKline. To browse the list of other pharma-developed compounds and Approved Drugs/Drug Candidates, click here.

Legal Information

Sold for research purposes under agreement from Glaxo­Smith­Kline

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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Certificates of Analysis (COA)

Lot/Batch Number
0000156241
0000070943
0000044414
0000029531

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