AC1LYP72
17-(4-ethylphenyl)-13-[(4-methylphenyl)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: 11-(4-ethylphenyl)-3-(4-methylbenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one|11-(4-ethylphenyl)-3-(4-methylbenzyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one
CAS: 836643-06-2
| Molecular Formula | C28H23N5O |
|---|---|
| Molecular Weight | 445.19025 g/mol |
| LogP | 5.20272 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.19025 |
| Monoisotopic Mass | 445.19025 |
| Heavy Atoms | 34 |
| Complexity | 1728.2695 |
Chemical Identifiers
| CAS Number | 836643-06-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC6=CC=C(C=C6)C |
Product Overview
AC1LYP72 (CAS 836643-06-2), with molecular formula C28H23N5O and molecular weight 445.19025 g/mol. IUPAC: 17-(4-ethylphenyl)-13-[(4-methylphenyl)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.
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.
View MSDS →
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