3-[2-(2-cyanoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-(2-cyanoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/abba5259ec334ebca58ab755f4d2bf24.png "3-[2-(2-cyanoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-(2-cyanoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
726166-22-9
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Formula:
C18H12N4O4
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Chemical Name:
3-[2-(2-cyanoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC3270323;AKOS002503406;MCULE-9796084744;AB00716948-01;Z19629985;3-{[(2-cyanophenyl)carbamoyl]methyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;726166-22-9
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CAS No:
3-[2-(2-cyanoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
348.3 g/mol
348.08585488 g/mol
Computed Properties
Molecular Weight:348.3
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:348.08585488
Monoisotopic Mass:348.08585488
Topological Polar Surface Area:123
Heavy Atom Count:26
Complexity:680
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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