AC1NZSC4
(6Z)-2-(2-cyclohexylethyl)-6-[[4-(dimethylamino)phenyl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: (Z)-2-(2-cyclohexylethyl)-6-(4-(dimethylamino)benzylidene)-5-imino-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one|(6Z)-2-(2-cyclohexylethyl)-6-[(4-dimethylaminophenyl)methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
CAS: 844449-89-4
| Molecular Formula | C22H27N5OS |
|---|---|
| Molecular Weight | 409.19363 g/mol |
| LogP | 4.73227 |
| Topological Polar Surface Area | 72.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.19363 |
| Monoisotopic Mass | 409.19363 |
| Heavy Atoms | 29 |
| Complexity | 894.28265 |
Chemical Identifiers
| CAS Number | 844449-89-4 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C\2/C(=N)N3C(=NC2=O)SC(=N3)CCC4CCCCC4 |
Product Overview
AC1NZSC4 (CAS 844449-89-4), with molecular formula C22H27N5OS and molecular weight 409.19363 g/mol. IUPAC: (6Z)-2-(2-cyclohexylethyl)-6-[[4-(dimethylamino)phenyl]methylidene]-5-imino-[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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