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Key Documents

R1658

Sigma-Aldrich

RS-102221 hydrochloride hydrate

≥98% (HPLC)

Synonym(s):

4-dione hydrochloride hydrate, 8-[5-(2,4-Dimethoxy-5-(4-trifluoromethylphenylsulphonam ido)phenyl-5-oxopentyl]-1,3,8-triazaspiro[4.5]decane-2

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About This Item

Empirical Formula (Hill Notation):
C27H31F3N4O7S·HCl · xH2O
CAS Number:
Molecular Weight:
649.08 (anhydrous basis)
MDL number:
UNSPSC Code:
12352202
PubChem Substance ID:

assay

≥98% (HPLC)

form

powder

color

white

solubility

DMSO: ≥20 mg/mL

storage temp.

2-8°C

SMILES string

O.Cl.COc1cc(OC)c(cc1NS(=O)(=O)c2ccc(cc2)C(F)(F)F)C(=O)CCCCN3CCC4(CC3)NC(=O)NC4=O

InChI

1S/C27H31F3N4O7S.ClH.H2O/c1-40-22-16-23(41-2)20(33-42(38,39)18-8-6-17(7-9-18)27(28,29)30)15-19(22)21(35)5-3-4-12-34-13-10-26(11-14-34)24(36)31-25(37)32-26;;/h6-9,15-16,33H,3-5,10-14H2,1-2H3,(H2,31,32,36,37);1H;1H2

InChI key

IGACJTZTAQBWKN-UHFFFAOYSA-N

Biochem/physiol Actions

RS-102221 is a selective, high affinity 5-HT2C receptor antagonist.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable


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Chris M Panzini et al.
Journal of neurochemistry, 143(6), 708-721 (2017-09-28)
In humans a chromosomal hemideletion of the 16p11.2 region results in variable neurodevelopmental deficits including developmental delay, intellectual disability, and features of autism spectrum disorder (ASD). Serotonin is implicated in ASD but its role remains enigmatic. In this study we

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