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2-Ethylsulfonylimidazo[1,2-a]pyridine-3-sulfonamide

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Name

2-Ethylsulfonylimidazo[1,2-a]pyridine-3-sulfonamide

EINECS 207-196-9
CAS No. 141776-47-8 Density 1.67 g/cm3
PSA 128.36000 LogP 2.63720
Solubility N/A Melting Point N/A
Formula C9H11N3O4S2 Boiling Point N/A
Molecular Weight 289.336 Flash Point N/A
Transport Information N/A Appearance White crystal
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 141776-47-8 (2-Ethylsulfonylimidazo[1,2-a]pyridine-3-sulfonamide) Hazard Symbols IrritantXi
Synonyms

2-(Ethylsulfonyl)imidazo[1,2-a]pyridine-3-sulfonamide;

 

2-Ethylsulfonylimidazo[1,2-a]pyridine-3-sulfonamide Synthetic route

2-ethylthioimidazo[1,2-a]pyridine-3-sulfonamide

141776-47-8

2-ethylsulfonylimidazo[1,2a]pyridine-3-sulfonamide

Conditions
ConditionsYield
With 3-chloro-benzenecarboperoxoic acid In N-methyl-acetamide; water
89392-03-0

O-phenyl N-(4,6-dimethoxypyrimidin-2-yl)carbamate

141776-47-8

2-ethylsulfonylimidazo[1,2a]pyridine-3-sulfonamide

N-(2-Ethylsulfonylimidazo[1,2-a]pyridin-3-ylsulfonyl)-N-(4,6-dimethoxy-2-pyrimidinyl)urea

Conditions
ConditionsYield
With 1,8-diazabicyclo[5.4.0]undec-7-ene In acetonitrile91.3%
89402-43-7

5-chloro-2,3-difluoropyridine

94050-90-5

(R)-2-(4-hydroxyphenoxy)propionic acid

141776-47-8

2-ethylsulfonylimidazo[1,2a]pyridine-3-sulfonamide

1361405-60-8

(R)-2-ethanesulfonylimidazo[1,2-a]pyridine-3-sulfonic acid [2-[4-(5-chloro-3-fluoropyridin-2-yloxy)phenoxy]propionyl]amide

Conditions
ConditionsYield
Stage #1: 5-chloro-2,3-difluoropyridine; (R)-2-(4-hydroxyphenoxy)propionic acid With potassium phosphate; tetra-(n-butyl)ammonium iodide In N,N-dimethyl-formamide at 50 - 60℃; for 2h;
Stage #2: With 1,3,5-trichloro-2,4,6-triazine In N,N-dimethyl-formamide at 5 - 25℃; for 1.16667h;
Stage #3: 2-ethylsulfonylimidazo[1,2a]pyridine-3-sulfonamide In N,N-dimethyl-formamide
74%
616-45-5

2-pyrrolidinon

141776-47-8

2-ethylsulfonylimidazo[1,2a]pyridine-3-sulfonamide

2-(ethylsulfonyl)-N-(pyrrolidin-2-ylidene)imidazo[1,2-a]pyridine-3-sulfonamide

Conditions
ConditionsYield
With diazoacetic acid ethyl ester; manganese(II) perchlorate hexahydrate In cyclohexane at 90℃; for 12h; chemoselective reaction;58%
1885-14-9

phenyl chloroformate

141776-47-8

2-ethylsulfonylimidazo[1,2a]pyridine-3-sulfonamide

905926-26-3

C16H15N3O6S2

Conditions
ConditionsYield
With triethylamine In acetonitrile at 3 - 20℃;

2-Ethylsulfonylimidazo[1,2-a]pyridine-3-sulfonamide Specification

The Imidazo[1,2-a]pyridine-3-sulfonamide,2-(ethylsulfonyl)-, with the CAS registry number 141776-47-8, is also known as 2-Ethylsulfonylimidazo[1,2-a]Pyridin-3-yl Sulfonamide. It belongs to the product category of Pyridines Derivates. This chemical's molecular formula is C9H11N3O4S2 and molecular weight is 289.33. What's more, both its IUPAC name and systematic name are the same which is called 2-Ethylsulfonylimidazo[1,2-a]pyridine-3-sulfonamide. And it's white crystal.

Physical properties about Imidazo[1,2-a]pyridine-3-sulfonamide,2-(ethylsulfonyl)- are: (1) ACD/LogP: 0.38; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 0.03; (4) ACD/BCF (pH 5.5): 1; (5) ACD/BCF (pH 7.4): 1; (6) ACD/KOC (pH 5.5): 17.22; (7) ACD/KOC (pH 7.4): 1; (8) #H bond acceptors: 7; (9) #H bond donors: 2; (10) #Freely Rotating Bonds: 3; (11) Polar Surface Area: 128.36 Å2; (12) Index of Refraction: 1.706; (13) Molar Refractivity: 67.16 cm3; (14) Molar Volume: 172.5 cm3; (15) Surface Tension: 75.1 dyne/cm; (16) Density: 1.67 g/cm3

When you are dealing with this chemical, you should be very careful. This chemical is irritant and may cause inflammation to the skin or other mucous membranes.

You can still convert the following datas into molecular structure:
(1) SMILES: CCS(=O)(=O)c1nc2ccccn2c1S(N)(=O)=O
(2) InChI: InChI=1/C9H11N3O4S2/c1-2-17(13,14)8-9(18(10,15)16)12-6-4-3-5-7(12)11-8/h3-6H,2H2,1H3,(H2,10,15,16)
(3) InChIKey: MJVXHAPMFSPZRH-UHFFFAOYAF

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