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2-chloro-N-[(3Z)-3-[1-cyano-2-oxo-2-(2-phenylethylamino)ethylidene]isoindol-1-yl]benzamide
2-chloro-N-[(3Z)-3-[1-cyano-2-oxo-2-(2-phenylethylamino)ethylidene]isoindol-1-yl]benzamide
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![2-chloro-N-[(3Z)-3-[1-cyano-2-oxo-2-(2-phenylethylamino)ethylidene]isoindol-1-yl]benzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/47e4fb9f74dd4c30bd7478c5be5cdf34.png "2-chloro-N-[(3Z)-3-[1-cyano-2-oxo-2-(2-phenylethylamino)ethylidene]isoindol-1-yl]benzamide")
2-chloro-N-[(3Z)-3-[1-cyano-2-oxo-2-(2-phenylethylamino)ethylidene]isoindol-1-yl]benzamide
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CAS No:
896083-95-7
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Formula:
C26H19ClN4O2
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Chemical Name:
2-chloro-N-[(3Z)-3-[1-cyano-2-oxo-2-(2-phenylethylamino)ethylidene]isoindol-1-yl]benzamide
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Synonyms:
ZINC2442052;STK581146;AKOS005504878;2-chloro-N-[(1Z)-1-{1-cyano-2-oxo-2-[(2-phenylethyl)amino]ethylidene}-1H-isoindol-3-yl]benzamide;896083-95-7
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CAS No:
2-chloro-N-[(3Z)-3-[1-cyano-2-oxo-2-(2-phenylethylamino)ethylidene]isoindol-1-yl]benzamide Basic Attributes
454.9 g/mol
454.1196536 g/mol
Computed Properties
Molecular Weight:454.9
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:454.1196536
Monoisotopic Mass:454.1196536
Topological Polar Surface Area:94.4
Heavy Atom Count:33
Complexity:852
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-chloro-N-[(3Z)-3-[1-cyano-2-oxo-2-(2-phenylethylamino)ethylidene]isoindol-1-yl]benzamide
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