AC1M19SG
(6E)-6-[[1-(2-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-(furan-2-yl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: (E)-6-((1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2-(furan-2-yl)-5-imino-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one|(6E)-6-[[1-(2-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-(furan-2-yl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(6E)-6-{[1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(furan-2-yl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
| Molecular Formula | C22H16ClN5O2S |
|---|---|
| Molecular Weight | 449.07132 g/mol |
| LogP | 5.00801 |
| Topological Polar Surface Area | 86.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 449.07132 |
| Monoisotopic Mass | 449.07132 |
| Heavy Atoms | 31 |
| Complexity | 1333.8707 |
Chemical Identifiers
| CAS Number | 862128-99-2 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=CC=C2Cl)C)/C=C/3\C(=N)N4C(=NC3=O)SC(=N4)C5=CC=CO5 |
Product Overview
AC1M19SG (CAS 862128-99-2), with molecular formula C22H16ClN5O2S and molecular weight 449.07132 g/mol. IUPAC: (6E)-6-[[1-(2-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-(furan-2-yl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.