2-amino-4-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
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![2-amino-4-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/561cf1d7bc5e4d1288ef23f9e4236ab7.png "2-amino-4-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile")
2-amino-4-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
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CAS No:
337505-86-9
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Formula:
C25H24N2O4
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Chemical Name:
2-amino-4-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
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Synonyms:
2-amino-4-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile;2-Amino-4-(3-methoxy-4-((4-methylbenzyl)oxy)phenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile;Oprea1_226260;Oprea1_354131;STK300013;AKOS000576266;AKOS022072531;MCULE-9576214306;AE-848/15341082;2-Amino-4-[3-methoxy-4-(4-methyl-benzyloxy)-phenyl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
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CAS No:
2-amino-4-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile Basic Attributes
416.46906
416.174
Computed Properties
Molecular Weight:416.5
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:416.17360725
Monoisotopic Mass:416.17360725
Topological Polar Surface Area:94.6
Heavy Atom Count:31
Complexity:800
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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