2-((1,1-Dioxidotetrahydrothiophen-3-yl)(methyl)amino)-2-oxoethyl 3-(3-nitrophenyl)acrylate

Base Information

• Chemical Name: 2-((1,1-Dioxidotetrahydrothiophen-3-yl)(methyl)amino)-2-oxoethyl 3-(3-nitrophenyl)acrylate
• CAS No.: 749872-43-3
• Molecular Formula: C16H18N2O7S
• Molecular Weight: 382.4
• ChEMBL ID: CHEMBL1330145
• Mol file: 749872-43-3.mol

Synonyms:749872-43-3;CID 5951923;cid-5951923;2-((1,1-Dioxidotetrahydrothiophen-3-yl)(methyl)amino)-2-oxoethyl 3-(3-nitrophenyl)acrylate;3-(3-nitro-phenyl)-acrylic acid [(1,1-dioxo-tetrahydro-1l6-thiophen-3-yl)-methyl-carbamoyl]-methyl ester;[2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] (E)-3-(3-nitrophenyl)prop-2-enoate;SR-01000765880;SR-01000765880-2;3-(3-Nitrophenyl)-2-propenoic Acid 2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl Ester;CID5951923;MLS000771732;CHEMBL1330145;SCHEMBL15605931;BDBM76096;cid_5951923;HMS2762N03;ZEB87243;KLF5 Inhibitor, CID 5951923;AKOS024458164;AKOS040745151;CS-W011760;HY-W011044;AS-16382;SMR000376412;E98742;EN300-364945;A899939;CID 5951923, >=98% (HPLC);Z18783212;2-((1,1-Dioxidotetrahydrothiophen-3-yl)(methyl)amino)-2-oxoethyl3-(3-nitrophenyl)acrylate;(E)-3-(3-nitrophenyl)-2-propenoic acid [2-[(1,1-dioxo-3-thiolanyl)-methylamino]-2-oxoethyl] ester;(E)-3-(3-nitrophenyl)acrylic acid [2-[(1,1-diketothiolan-3-yl)-methyl-amino]-2-keto-ethyl] ester;[(1,1-dioxo-1lambda6-thiolan-3-yl)(methyl)carbamoyl]methyl (2E)-3-(3-nitrophenyl)prop-2-enoate;[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-2-oxidanylidene-ethyl] (E)-3-(3-nitrophenyl)prop-2-enoate;2-((1,1-dioxidotetrahydrothiophen-3-yl)(methyl)amino)-2-oxoethyl (E)-3-(3-nitrophenyl)acrylate;2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl (E)-3-(3-nitrophenyl)prop-2-enoate;2-[Methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]-2-oxoethyl 3-(3-nitrophenyl)prop-2-enoate

Chemical Property of 2-((1,1-Dioxidotetrahydrothiophen-3-yl)(methyl)amino)-2-oxoethyl 3-(3-nitrophenyl)acrylate

Chemical Property:

• Storage Temp.: room temp
• Solubility.: DMSO: soluble10mg/mL (clear solution)
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 382.08347209
• Heavy Atom Count: 26
• Complexity: 678

Purity/Quality:

97% ^*data from raw suppliers

CID 5951923 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]
• Isomeric SMILES: CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]
• Uses: 2-((1,1-Dioxidotetrahydrothiophen-3-yl)(methyl)amino)-2-oxoethyl 3-(3-nitrophenyl)acrylate acts as a KLF-5 expression inhibitor. which in turn reduces proliferation cell rates in colorectal cancer cells in humans.

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