3-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9cb2b92c7dd244d39ed269f20aefe91a.png "3-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
726166-24-1
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Formula:
C19H17N3O4
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Chemical Name:
3-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC3270328;AKOS002502310;MCULE-9087782102;AB00716946-01;Z19629969;3-{[(3,4-dimethylphenyl)carbamoyl]methyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;726166-24-1
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CAS No:
3-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
351.4 g/mol
351.12190603 g/mol
Computed Properties
Molecular Weight:351.4
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:351.12190603
Monoisotopic Mass:351.12190603
Topological Polar Surface Area:99.1
Heavy Atom Count:26
Complexity:618
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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