ethyl 4-(13-hexyl-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 4-(13-hexyl-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:
799786-71-3
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Formula:
C27H27N5O3
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Chemical Name:
ethyl 4-(13-hexyl-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:
ZINC2214214;STK552218;AKOS005479491;MCULE-7913761897;799786-71-3;ethyl 4-(3-hexyl-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 4-(13-hexyl-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
469.5 g/mol
469.21138974 g/mol
Computed Properties
Molecular Weight:469.5
XLogP3:5.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:469.21138974
Monoisotopic Mass:469.21138974
Topological Polar Surface Area:89.7
Heavy Atom Count:35
Complexity:783
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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