3-[2-(2-iodoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-(2-iodoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d3422279a62f47b5be4f870d5d04d283.png "3-[2-(2-iodoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-(2-iodoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
851203-40-2
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Formula:
C17H12IN3O4
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Chemical Name:
3-[2-(2-iodoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC3345314;MCULE-3094094739;AB00730260-01;SR-01000062425;SR-01000062425-1;Z19628946;3-{[(2-iodophenyl)carbamoyl]methyl}-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;851203-40-2
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CAS No:
3-[2-(2-iodoanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
449.20 g/mol
448.98725 g/mol
Computed Properties
Molecular Weight:449.20
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:448.98725
Monoisotopic Mass:448.98725
Topological Polar Surface Area:99.1
Heavy Atom Count:25
Complexity:594
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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