AC1NYL2C
(6Z)-5-imino-2-pentan-3-yl-6-[[4-(2-phenoxyethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: (6Z)-5-imino-2-pentan-3-yl-6-[[4-(2-phenoxyethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(Z)-5-imino-2-(pentan-3-yl)-6-(4-(2-phenoxyethoxy)benzylidene)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
CAS: 877797-99-4
| Molecular Formula | C25H26N4O3S |
|---|---|
| Molecular Weight | 462.17258 g/mol |
| LogP | 5.19977 |
| Topological Polar Surface Area | 87.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 462.17258 |
| Monoisotopic Mass | 462.17258 |
| Heavy Atoms | 33 |
| Complexity | 1106.2318 |
Chemical Identifiers
| CAS Number | 877797-99-4 |
|---|---|
| SMILES | CCC(CC)C1=NN2C(=N)/C(=C/C3=CC=C(C=C3)OCCOC4=CC=CC=C4)/C(=O)N=C2S1 |
Product Overview
AC1NYL2C (CAS 877797-99-4), with molecular formula C25H26N4O3S and molecular weight 462.17258 g/mol. IUPAC: (6Z)-5-imino-2-pentan-3-yl-6-[[4-(2-phenoxyethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-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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