[2-(4-cyanoanilino)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
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[2-(4-cyanoanilino)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
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CAS No:
474259-10-4
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Formula:
C16H13N3O3S
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Chemical Name:
[2-(4-cyanoanilino)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
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Synonyms:
474259-10-4;Oprea1_557199;ZINC2636473;AKOS002485527;MCULE-2951490623;AB00723691-01;SR-01000051476;SR-01000051476-1;Z18837919;2-((4-Cyanophenyl)amino)-2-oxoethyl 2-(methylthio)nicotinate;[(4-cyanophenyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate
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CAS No:
[2-(4-cyanoanilino)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Basic Attributes
327.4 g/mol
327.06776246 g/mol
Computed Properties
Molecular Weight:327.4
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:327.06776246
Monoisotopic Mass:327.06776246
Topological Polar Surface Area:117
Heavy Atom Count:23
Complexity:468
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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