3,9-di(butan-2-yl)-6,12-di(propan-2-yl)-1,7-dioxa-4,10-diazacyclododecane-2,5,8,11-tetrone
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3,9-di(butan-2-yl)-6,12-di(propan-2-yl)-1,7-dioxa-4,10-diazacyclododecane-2,5,8,11-tetrone
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CAS No:
2441-03-4
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Formula:
C22H38N2O6
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Chemical Name:
3,9-di(butan-2-yl)-6,12-di(propan-2-yl)-1,7-dioxa-4,10-diazacyclododecane-2,5,8,11-tetrone
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Synonyms:
ANGOLIDE;2441-03-4;Cyclic(D-alloisoleucyl-L-.alpha.-hydroxyisovaleryl-L-isoleucyl-L-.alpha.-hydroxyisovaleryl);Cyclo(D-alloisoleucyl-L-.alpha.-hydroxyisovaleryl-L-isoleucyl-L-.alpha.-hydroxy-isovaleryl);3,9-di(butan-2-yl)-6,12-di(propan-2-yl)-1,7-dioxa-4,10-diazacyclododecane-2,5,8,11-tetrone;DTXSID20298588;NSC124461;NSC-124461;Alloisoleucine, cyclic ester with N-(L-2-hydroxy-3-methylbutyryl)-L-isoleucine, D-;3,9-Disec-butyl-11-hydroxy-6,12-diisopropyl-1,7-dioxa-4,10-diazacyclododec-10-ene-2,5,8-trione #;Alloisoleucine, N-(L-2-hydroxy-3-methylbutyryl)-, cyclic ester with N-(L-2-hydroxy-3-methylbutyryl)-L-isoleucine, D-
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CAS No:
3,9-di(butan-2-yl)-6,12-di(propan-2-yl)-1,7-dioxa-4,10-diazacyclododecane-2,5,8,11-tetrone Basic Attributes
426.5 g/mol
426.27298694 g/mol
124461
DTXSID20298588
Computed Properties
Molecular Weight:426.5
XLogP3:4.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:426.27298694
Monoisotopic Mass:426.27298694
Topological Polar Surface Area:111
Heavy Atom Count:30
Complexity:579
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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