AC1O0ZIA
[4-[(Z)-[2-(2-cyclohexylethyl)-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate
Also Known As: (Z)-4-((2-(2-cyclohexylethyl)-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate|[4-[(Z)-[2-(2-cyclohexylethyl)-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate
CAS: 848746-76-9
| Molecular Formula | C25H24N4O4S |
|---|---|
| Molecular Weight | 476.15182 g/mol |
| LogP | 5.47847 |
| Topological Polar Surface Area | 108.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.15182 |
| Monoisotopic Mass | 476.15182 |
| Heavy Atoms | 34 |
| Complexity | 1192.0137 |
Chemical Identifiers
| CAS Number | 848746-76-9 |
|---|---|
| SMILES | C1CCC(CC1)CCC2=NN3C(=N)/C(=C/C4=CC=C(C=C4)OC(=O)C5=CC=CO5)/C(=O)N=C3S2 |
Product Overview
AC1O0ZIA (CAS 848746-76-9), with molecular formula C25H24N4O4S and molecular weight 476.15182 g/mol. IUPAC: [4-[(Z)-[2-(2-cyclohexylethyl)-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate.
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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