(3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-1H-indol-2-one

Base Information

• Chemical Name: (3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-1H-indol-2-one
• CAS No.: 370577-17-6
• Molecular Formula: C₁₈H₁₅NO₄
• Molecular Weight: 309.321
• DSSTox Substance ID: DTXSID701325888
• ChEMBL ID: CHEMBL1549231

Synonyms:MLS001163860;SMR000539203;(3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-1H-indol-2-one;cid_947879;CHEMBL1549231;BDBM72846;DTXSID701325888;STK540460;AKOS005470426;370577-17-6;(3E)-3-[2-(3,4-dimethoxyphenyl)-2-keto-ethylidene]oxindole;(E)-3-(2-(3,4-dimethoxyphenyl)-2-oxoethylidene)indolin-2-one;(3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethylidene]-1H-indol-2-one;(3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-1,3-dihydro-2H-indol-2-one

Chemical Property of (3E)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-1H-indol-2-one

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 309.10010796
• Heavy Atom Count: 23
• Complexity: 501

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MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C(=O)C=C2C3=CC=CC=C3NC2=O)OC
• Isomeric SMILES: COC1=C(C=C(C=C1)C(=O)/C=C/2\C3=CC=CC=C3NC2=O)OC

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