3-methylthio-2-oxo-2,3-dihydro-1H-indole-5-carboxylic acid methyl ester

Base Information

• Chemical Name: 3-methylthio-2-oxo-2,3-dihydro-1H-indole-5-carboxylic acid methyl ester
• CAS No.: 222036-28-4
• Molecular Formula: C₁₁H₁₁NO₃S
• Molecular Weight: 237.279
• DSSTox Substance ID: DTXSID701175792

Synonyms:SCHEMBL5894164;BYSSVRDEIAZSQC-UHFFFAOYSA-N;DTXSID701175792;Methyl 2,3-dihydro-3-(methylthio)-2-oxo-1H-indole-5-carboxylate;3-methylthio-2-oxo-2,3-dihydro-1H-indole-5-carboxylic acid methyl ester;222036-28-4

Chemical Property of 3-methylthio-2-oxo-2,3-dihydro-1H-indole-5-carboxylic acid methyl ester

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 237.04596439
• Heavy Atom Count: 16
• Complexity: 308

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• Canonical SMILES: COC(=O)C1=CC2=C(C=C1)NC(=O)C2SC

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