AC1LZTIR
1-[2-(4-methoxyphenyl)-6-phenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]butan-1-one
Also Known As: 1-(4-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl)butan-1-one|1-[4-(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]butan-1-one
CAS: 844836-22-2
| Molecular Formula | C27H28N2O2 |
|---|---|
| Molecular Weight | 412.2151 g/mol |
| LogP | 6.4025 |
| Topological Polar Surface Area | 35.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.2151 |
| Monoisotopic Mass | 412.2151 |
| Heavy Atoms | 31 |
| Complexity | 1230.2213 |
Chemical Identifiers
| CAS Number | 844836-22-2 |
|---|---|
| SMILES | CCCC(=O)C1=C(C2=C3N1C=C(N3CCCC2)C4=CC=C(C=C4)OC)C5=CC=CC=C5 |
Product Overview
AC1LZTIR (CAS 844836-22-2), with molecular formula C27H28N2O2 and molecular weight 412.2151 g/mol. IUPAC: 1-[2-(4-methoxyphenyl)-6-phenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]butan-1-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.
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