1,3-Diethyl 2-[[[2,4-difluoro-3-(3-pyridinyl)phenyl]ethylamino]methylene]propanedioate

Base Information

• Chemical Name: 1,3-Diethyl 2-[[[2,4-difluoro-3-(3-pyridinyl)phenyl]ethylamino]methylene]propanedioate
• CAS No.: 100325-53-9
• Molecular Formula: C21H22F2N2O4
• DSSTox Substance ID: DTXSID801125952

Synonyms:SCHEMBL10532056;DTXSID801125952;1,3-Diethyl 2-[[[2,4-difluoro-3-(3-pyridinyl)phenyl]ethylamino]methylene]propanedioate;100325-53-9

Chemical Property of 1,3-Diethyl 2-[[[2,4-difluoro-3-(3-pyridinyl)phenyl]ethylamino]methylene]propanedioate

Chemical Property:

• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 10
• Exact Mass: 404.15476351
• Heavy Atom Count: 29
• Complexity: 567

Purity/Quality:

98%min ^*data from raw suppliers

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• Canonical SMILES: CCN(C=C(C(=O)OCC)C(=O)OCC)C1=C(C(=C(C=C1)F)C2=CN=CC=C2)F

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