3-[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5d859c8c08154cb8b373e619f417b3fd.png "3-[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
756859-93-5
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Formula:
C20H15FN4O4
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Chemical Name:
3-[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC2617685;AKOS002503364;MCULE-8546693792;NCGC00285668-01;AB01285072-01;Z19629208;3-{[(2-cyanoethyl)(4-fluorophenyl)carbamoyl]methyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;756859-93-5
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CAS No:
3-[2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
394.4 g/mol
394.10773313 g/mol
Computed Properties
Molecular Weight:394.4
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:394.10773313
Monoisotopic Mass:394.10773313
Topological Polar Surface Area:114
Heavy Atom Count:29
Complexity:738
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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