AC1LD67R structure

AC1LD67R

13-[(2-chlorophenyl)methyl]-17-(furan-2-ylmethyl)-14-methyl-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-(2-chlorobenzyl)-11-(furan-2-ylmethyl)-2-methyl-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one|3-(2-chlorobenzyl)-11-(furan-2-ylmethyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

CAS: 836633-58-0
Molecular Formula C25H18ClN5O2
Molecular Weight 455.1149 g/mol
LogP 3.8
Topological Polar Surface Area 76.5 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 455.1149
Monoisotopic Mass 455.1149
Heavy Atoms 33
Complexity 780.0

Chemical Identifiers

CAS Number 836633-58-0
SMILES CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CC5=CC=CO5)C(=O)N1CC6=CC=CC=C6Cl
InChIKey LIBZEUIRMKLMMN-UHFFFAOYSA-N

Product Overview

AC1LD67R (CAS 836633-58-0), with molecular formula C25H18ClN5O2 and molecular weight 455.1149 g/mol. IUPAC: 13-[(2-chlorophenyl)methyl]-17-(furan-2-ylmethyl)-14-methyl-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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