2-[2-acetyloxyethyl-[(6aR,9R)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carbonyl]amino]ethyl acetate
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2-[2-acetyloxyethyl-[(6aR,9R)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carbonyl]amino]ethyl acetate
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CAS No:
109002-91-7
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Formula:
C24H31N3O5
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Chemical Name:
2-[2-acetyloxyethyl-[(6aR,9R)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carbonyl]amino]ethyl acetate
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Synonyms:
AWD 52-39;AWD-52-39;N,N-diacetoxyethyl 9,10-dihydrolysergic acid amide;109002-91-7;Awd-52-39;Awd 52-39;N,N-Diacetoxyethyl 9,10-dihydrolysergic acid amide;DTXSID40910957;{[(6-Methylergolin-8-yl)carbonyl]azanediyl}di(ethane-2,1-diyl) diacetate;Ergoline-8-carboxamide, N,N-bis(2-(acetyloxy)ethyl)-6-methyl-, (8beta)-
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CAS No:
2-[2-acetyloxyethyl-[(6aR,9R)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carbonyl]amino]ethyl acetate Basic Attributes
441.5 g/mol
441.22637110 g/mol
Computed Properties
Molecular Weight:441.5
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:441.22637110
Monoisotopic Mass:441.22637110
Topological Polar Surface Area:91.9
Heavy Atom Count:32
Complexity:696
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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