(2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one
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![(2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ce46b109e94f4741968bc9a281276c0d.png "(2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one")
(2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one
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CAS No:
896074-37-6
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Formula:
C22H22N2O5
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Chemical Name:
(2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one
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Synonyms:
896074-37-6;(Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-(4-nitrobenzylidene)benzofuran-3(2H)-one;(2Z)-7-[(azepan-1-yl)methyl]-6-hydroxy-2-[(4-nitrophenyl)methylidene]-2,3-dihydro-1-benzofuran-3-one;ZINC2438476;STK991977;AKOS002217681;(2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one;ST50474673;F3385-2307;(2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-(4-nitrobenzylidene)-1-benzofuran-3(2H)-one;7-(azaperhydroepinylmethyl)-6-hydroxy-2-[(4-nitrophenyl)methylene]benzo[b]fura n-3-one
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CAS No:
(2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one Basic Attributes
394.4 g/mol
394.15287181 g/mol
Computed Properties
Molecular Weight:394.4
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:394.15287181
Monoisotopic Mass:394.15287181
Topological Polar Surface Area:95.6
Heavy Atom Count:29
Complexity:630
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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