(2S)-2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxochromen-2-yl)-2-fluorophenyl]hexanamide
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(2S)-2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxochromen-2-yl)-2-fluorophenyl]hexanamide
structure -
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CAS No:
468719-52-0
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Formula:
C22H23F3N4O3
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Chemical Name:
(2S)-2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxochromen-2-yl)-2-fluorophenyl]hexanamide
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Synonyms:
AFP-464 free base;UNII-O3HFV0VQ36;468719-52-0 (free base);O3HFV0VQ36;468719-52-0;(2S)-2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxochromen-2-yl)-2-fluorophenyl]hexanamide;NCI60_038882;SCHEMBL1560143;CHEMBL2007884;DTXSID80196970;ZINC1862893;Hexanamide, 2,6-diamino-N-(4-(5-amino-6,8-difluoro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)-2-fluorophenyl)-, (2S)-;HY-16031;NCI60_036618;CS-0006122;Q27285280
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CAS No:
(2S)-2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxochromen-2-yl)-2-fluorophenyl]hexanamide Basic Attributes
448.4 g/mol
448.17222509 g/mol
O3HFV0VQ36
DTXSID80196970
Computed Properties
Molecular Weight:448.4
XLogP3:2.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:448.17222509
Monoisotopic Mass:448.17222509
Topological Polar Surface Area:134
Heavy Atom Count:32
Complexity:725
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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