ethyl 3-(13-hexyl-14-methyl-12-oxo-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-17-yl)benzoate
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ethyl 3-(13-hexyl-14-methyl-12-oxo-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-17-yl)benzoate
structure -
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CAS No:
847178-02-3
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Formula:
C28H29N5O3
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Chemical Name:
ethyl 3-(13-hexyl-14-methyl-12-oxo-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-17-yl)benzoate
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Synonyms:
ZINC2393271;STK920437;AKOS005645297;MCULE-8979906232;847178-02-3;ethyl 3-(3-hexyl-2-methyl-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl)benzoate
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CAS No:
ethyl 3-(13-hexyl-14-methyl-12-oxo-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-17-yl)benzoate Basic Attributes
483.6 g/mol
483.22703980 g/mol
Computed Properties
Molecular Weight:483.6
XLogP3:5.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:483.22703980
Monoisotopic Mass:483.22703980
Topological Polar Surface Area:89.7
Heavy Atom Count:36
Complexity:834
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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