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R1658

Sigma-Aldrich

RS-102221 hydrochloride hydrate

≥98% (HPLC)

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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
Empirical Formula (Hill Notation):
C27H31F3N4O7S·HCl · xH2O
CAS Number:
185376-97-0
Molecular Weight:
649.08 (anhydrous basis)
MDL number:
MFCD18452853
UNSPSC Code:
12352202
PubChem Substance ID:
329824005

Quality Level

100

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
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

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

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Regulatory Information

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