3-[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/85e1e317bf574f048cf8f958679501d3.png "3-[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
728900-71-8
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Formula:
C18H13Cl2N3O4
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Chemical Name:
3-[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC3274365;AKOS002503608;MCULE-7913931977;Z19630096;3-{[(2,6-dichloro-3-methylphenyl)carbamoyl]methyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;728900-71-8
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CAS No:
3-[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
406.2 g/mol
405.0283113 g/mol
Computed Properties
Molecular Weight:406.2
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:405.0283113
Monoisotopic Mass:405.0283113
Topological Polar Surface Area:99.1
Heavy Atom Count:27
Complexity:657
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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