3-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/139975f2232f425abe7cb4ca355ab468.png "3-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
742090-22-8
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Formula:
C25H18N4O4S
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Chemical Name:
3-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
ZINC3310596;AKOS002502397;MCULE-6374800056;Z19629996;3-({[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl}methyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;742090-22-8
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CAS No:
3-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
470.5 g/mol
470.10487624 g/mol
Computed Properties
Molecular Weight:470.5
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:470.10487624
Monoisotopic Mass:470.10487624
Topological Polar Surface Area:140
Heavy Atom Count:34
Complexity:843
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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