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Home > Encyclopedia > butyl 4-[13-(3-methylbutyl)-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

butyl 4-[13-(3-methylbutyl)-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

butyl 4-[13-(3-methylbutyl)-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

butyl 4-[13-(3-methylbutyl)-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
  • CAS No:

    845666-49-1

  • Formula:

    C28H29N5O3

  • Chemical Name:

    butyl 4-[13-(3-methylbutyl)-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

  • Synonyms:

    ZINC2416691;STK990494;AKOS005644630;MCULE-2580363751;845666-49-1;butyl 4-[3-(3-methylbutyl)-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl]benzoate

butyl 4-[13-(3-methylbutyl)-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

Characteristics

89.7 Ų

Computed Properties

Molecular Weight:483.6
XLogP3:5.5
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:811
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of butyl 4-[13-(3-methylbutyl)-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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