[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate
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![[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4095922d35f943e498f268bafe7548b0.png "[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate")
[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate
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CAS No:
851610-77-0
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Formula:
C19H13F2N3O6
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Chemical Name:
[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate
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Synonyms:
ZINC3350313;AKOS033634055;MCULE-3043161927;Z18635999;[(2,2-difluoro-2H-1,3-benzodioxol-5-yl)carbamoyl]methyl 4-(2-cyanoacetamido)benzoate;851610-77-0
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CAS No:
[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 4-[(2-cyanoacetyl)amino]benzoate Basic Attributes
417.3 g/mol
417.07724147 g/mol
Computed Properties
Molecular Weight:417.3
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:417.07724147
Monoisotopic Mass:417.07724147
Topological Polar Surface Area:127
Heavy Atom Count:30
Complexity:716
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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