3-[2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c708758a29a24afabab25ea61abbb140.png "3-[2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
728910-71-2
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Formula:
C20H19N3O6
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Chemical Name:
3-[2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC3278541;AKOS002502550;MCULE-7080192280;Z19628939;3-{2-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]-2-oxoethyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;728910-71-2
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CAS No:
3-[2-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
397.4 g/mol
397.12738533 g/mol
Computed Properties
Molecular Weight:397.4
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:397.12738533
Monoisotopic Mass:397.12738533
Topological Polar Surface Area:129
Heavy Atom Count:29
Complexity:736
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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