AC1LYBD3 structure

AC1LYBD3

13-heptyl-17-(4-methoxyphenyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one

Also Known As: 3-heptyl-11-(4-methoxyphenyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one|3-heptyl-11-(4-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

CAS: 845902-18-3
Molecular Formula C26H27N5O2
Molecular Weight 441.21646 g/mol
LogP 5.2626
Topological Polar Surface Area 74.83 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 441.21646
Monoisotopic Mass 441.21646
Heavy Atoms 33
Complexity 1484.7073

Chemical Identifiers

CAS Number 845902-18-3
SMILES CCCCCCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)OC

Product Overview

AC1LYBD3 (CAS 845902-18-3), with molecular formula C26H27N5O2 and molecular weight 441.21646 g/mol. IUPAC: 13-heptyl-17-(4-methoxyphenyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one.

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