3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/922aa670251c43d7838c42e388863eb7.png "3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
796118-30-4
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Formula:
C22H25N3O4
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Chemical Name:
3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC3323641;AKOS002503595;MCULE-2951682142;AB00746634-01;Z19629774;3-{2-[2,5-dimethyl-1-(3-methylbutyl)-1H-pyrrol-3-yl]-2-oxoethyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;796118-30-4
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CAS No:
3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
395.5 g/mol
395.18450629 g/mol
Computed Properties
Molecular Weight:395.5
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:395.18450629
Monoisotopic Mass:395.18450629
Topological Polar Surface Area:92
Heavy Atom Count:29
Complexity:690
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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