2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylic acid

Base Information

• Chemical Name: 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylic acid
• CAS No.: 5900-31-2
• Molecular Formula: C16H11NO4S2
• DSSTox Substance ID: DTXSID20356677
• Wikidata: Q82136191

Synonyms:5900-31-2;AC1LGWYH;DTXSID20356677;BIM-0036272.P001

Chemical Property of 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylic acid

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 345.01295018
• Heavy Atom Count: 23
• Complexity: 485

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=COC(=C1)C=CC(=O)NC2=C(C(=CS2)C3=CC=CS3)C(=O)O
• Isomeric SMILES: C1=COC(=C1)/C=C/C(=O)NC2=C(C(=CS2)C3=CC=CS3)C(=O)O

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