AC1LUM4M
N-(4-ethoxyphenyl)-6-(4-methoxyphenyl)-2-phenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
Also Known As: N-(4-ethoxyphenyl)-1-(4-methoxyphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
CAS: 397291-20-2
| Molecular Formula | C32H31N3O2S |
|---|---|
| Molecular Weight | 521.2137 g/mol |
| LogP | 7.606 |
| Topological Polar Surface Area | 39.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 521.2137 |
| Monoisotopic Mass | 521.2137 |
| Heavy Atoms | 38 |
| Complexity | 1582.5463 |
Chemical Identifiers
| CAS Number | 397291-20-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=S)C2=C(C3=C4N2C=C(N4CCCC3)C5=CC=CC=C5)C6=CC=C(C=C6)OC |
Product Overview
AC1LUM4M (CAS 397291-20-2), with molecular formula C32H31N3O2S and molecular weight 521.2137 g/mol. IUPAC: N-(4-ethoxyphenyl)-6-(4-methoxyphenyl)-2-phenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide.
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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