AC1M45I3
(5E)-1-(3-fluorophenyl)-5-[[1-(4-fluorophenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: (5E)-1-(3-fluorophenyl)-5-[[1-(4-fluorophenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione|(5E)-1-(3-fluorophenyl)-5-{[1-(4-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
CAS: 640252-73-9
| Molecular Formula | C21H13F2N3O2S |
|---|---|
| Molecular Weight | 409.06964 g/mol |
| LogP | 3.5868 |
| Topological Polar Surface Area | 54.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.06964 |
| Monoisotopic Mass | 409.06964 |
| Heavy Atoms | 29 |
| Complexity | 1168.6791 |
Chemical Identifiers
| CAS Number | 640252-73-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)N2C(=O)/C(=C/C3=CC=CN3C4=CC=C(C=C4)F)/C(=O)NC2=S |
Product Overview
AC1M45I3 (CAS 640252-73-9), with molecular formula C21H13F2N3O2S and molecular weight 409.06964 g/mol. IUPAC: (5E)-1-(3-fluorophenyl)-5-[[1-(4-fluorophenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-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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