3-[2-(2-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-(2-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e18f3c249ebe4252bb812cc3f34b8ed0.png "3-[2-(2-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-(2-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
728893-17-2
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Formula:
C18H15N3O4
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Chemical Name:
3-[2-(2-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
MLS001166712;CHEMBL1869483;HMS2895G18;ZINC3271856;AKOS002503458;MCULE-5801004023;SMR000591157;AB00716979-01;Z19629988;3-{[(2-methylphenyl)carbamoyl]methyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;728893-17-2
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CAS No:
3-[2-(2-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
337.3 g/mol
337.10625597 g/mol
Computed Properties
Molecular Weight:337.3
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:337.10625597
Monoisotopic Mass:337.10625597
Topological Polar Surface Area:99.1
Heavy Atom Count:25
Complexity:589
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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