AC1LUZ1O
2-chloro-4-[5-[(E)-[1-(3-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid
Also Known As: (E)-2-chloro-4-(5-((1-(3-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl)furan-2-yl)benzoic acid|2-chloro-4-[5-[(E)-[1-(3-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid
CAS: 577989-25-4
| Molecular Formula | C22H12ClFN2O5S |
|---|---|
| Molecular Weight | 470.01395 g/mol |
| LogP | 4.2686 |
| Topological Polar Surface Area | 99.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 470.01395 |
| Monoisotopic Mass | 470.01395 |
| Heavy Atoms | 32 |
| Complexity | 1333.3604 |
Chemical Identifiers
| CAS Number | 577989-25-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)N2C(=O)/C(=C/C3=CC=C(O3)C4=CC(=C(C=C4)C(=O)O)Cl)/C(=O)NC2=S |
Product Overview
AC1LUZ1O (CAS 577989-25-4), with molecular formula C22H12ClFN2O5S and molecular weight 470.01395 g/mol. IUPAC: 2-chloro-4-[5-[(E)-[1-(3-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoic acid.
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.
View MSDS →
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