AC1MPJEY
4-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: 4-(3-fluoro-4-methylbenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)-2,5-dihydro-1H-pyrrol-2-one|4-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
CAS: 867136-59-2
| Molecular Formula | C21H15FN4O5S |
|---|---|
| Molecular Weight | 454.0747 g/mol |
| LogP | 3.82854 |
| Topological Polar Surface Area | 126.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.0747 |
| Monoisotopic Mass | 454.0747 |
| Heavy Atoms | 32 |
| Complexity | 1301.7738 |
Chemical Identifiers
| CAS Number | 867136-59-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NN=C(S3)C)C4=CC=C(C=C4)[N+](=O)[O-])O)F |
Product Overview
AC1MPJEY (CAS 867136-59-2), with molecular formula C21H15FN4O5S and molecular weight 454.0747 g/mol. IUPAC: 4-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione.
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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