AC1MX345 structure

AC1MX345

14-methyl-13-[(4-methylphenyl)methyl]-17-pentyl-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: 2-methyl-3-(4-methylbenzyl)-11-pentyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one|2-methyl-3-(4-methylbenzyl)-11-pentyl-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one

CAS: 836626-48-3
Molecular Formula C26H27N5O
Molecular Weight 425.22156 g/mol
LogP 5.14974
Topological Polar Surface Area 65.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 6
Exact Mass 425.22156
Monoisotopic Mass 425.22156
Heavy Atoms 32
Complexity 1495.0637

Chemical Identifiers

CAS Number 836626-48-3
SMILES CCCCCN1C2=C(C3=NC4=CC=CC=C4N=C31)C(=O)N(C(=N2)C)CC5=CC=C(C=C5)C

Product Overview

AC1MX345 (CAS 836626-48-3), with molecular formula C26H27N5O and molecular weight 425.22156 g/mol. IUPAC: 14-methyl-13-[(4-methylphenyl)methyl]-17-pentyl-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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