AC1NQGQF
5-[[3-(4-butoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-{[3-(4-Butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-one|5-[[3-(4-butoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-one
CAS: 6612-75-5
| Molecular Formula | C32H39N3O2S2 |
|---|---|
| Molecular Weight | 561.24835 g/mol |
| LogP | 8.58832 |
| Topological Polar Surface Area | 47.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 561.24835 |
| Monoisotopic Mass | 561.24835 |
| Heavy Atoms | 39 |
| Complexity | 1299.9979 |
Chemical Identifiers
| CAS Number | 6612-75-5 |
|---|---|
| SMILES | CCCCCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OCCCC)C)C4=CC=CC=C4)SC1=S |
Product Overview
AC1NQGQF (CAS 6612-75-5), with molecular formula C32H39N3O2S2 and molecular weight 561.24835 g/mol. IUPAC: 5-[[3-(4-butoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-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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