AC1LYMXS structure

AC1LYMXS

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

CAS: 836629-58-4
Molecular Formula C24H20ClN5O
Molecular Weight 429.13565 g/mol
LogP 5.36052
Topological Polar Surface Area 65.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 429.13565
Monoisotopic Mass 429.13565
Heavy Atoms 31
Complexity 1545.2936

Chemical Identifiers

CAS Number 836629-58-4
SMILES CC1=C(C=C(C=C1)Cl)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)C6CCCC6

Product Overview

AC1LYMXS (CAS 836629-58-4), with molecular formula C24H20ClN5O and molecular weight 429.13565 g/mol. IUPAC: 17-(5-chloro-2-methylphenyl)-13-cyclopentyl-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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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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