3-[2-(2,6-diethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-(2,6-diethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8ef87c77c6884e82bf509c3b46b052bc.png "3-[2-(2,6-diethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-(2,6-diethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
729569-14-6
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Formula:
C21H21N3O4
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Chemical Name:
3-[2-(2,6-diethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC3283734;AKOS002502378;MCULE-9755616682;NCGC00305306-01;AB00716168-01;AB00716168-02;Z19630042;3-{[(2,6-diethylphenyl)carbamoyl]methyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;729569-14-6
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CAS No:
3-[2-(2,6-diethylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
379.4 g/mol
379.15320616 g/mol
Computed Properties
Molecular Weight:379.4
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:379.15320616
Monoisotopic Mass:379.15320616
Topological Polar Surface Area:99.1
Heavy Atom Count:28
Complexity:636
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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