AC1M3CRP
(5E)-1-(3-chloro-2-methylphenyl)-5-[[1-(2-fluorophenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: (5E)-1-(3-chloro-2-methylphenyl)-5-[[1-(2-fluorophenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione|(5E)-1-(3-chloro-2-methylphenyl)-5-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
CAS: 593271-48-8
| Molecular Formula | C22H15ClFN3O2S |
|---|---|
| Molecular Weight | 439.05576 g/mol |
| LogP | 4.40952 |
| Topological Polar Surface Area | 54.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 439.05576 |
| Monoisotopic Mass | 439.05576 |
| Heavy Atoms | 30 |
| Complexity | 1234.6255 |
Chemical Identifiers
| CAS Number | 593271-48-8 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)N2C(=O)/C(=C/C3=CC=CN3C4=CC=CC=C4F)/C(=O)NC2=S |
Product Overview
AC1M3CRP (CAS 593271-48-8), with molecular formula C22H15ClFN3O2S and molecular weight 439.05576 g/mol. IUPAC: (5E)-1-(3-chloro-2-methylphenyl)-5-[[1-(2-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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