AC1NRNTZ
1-[3-(dimethylazaniumyl)propyl]-3-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-5-oxo-2-thiophen-2-yl-2H-pyrrol-4-olate
Also Known As: 1-[3-(dimethylazaniumyl)propyl]-3-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-5-oxo-2-thiophen-2-yl-2H-pyrrol-4-olate|(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate|1-[3-(Dimethylazaniumyl)propyl]-4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-2-oxo-5-(thiophen-2-yl)-2,5-dihydro-1H-pyrrol-3-olate
CAS: 5697-06-3
| Molecular Formula | C19H23N3O3S2 |
|---|---|
| Molecular Weight | 405.11807 g/mol |
| LogP | 0.73664 |
| Topological Polar Surface Area | 77.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 405.11807 |
| Monoisotopic Mass | 405.11807 |
| Heavy Atoms | 27 |
| Complexity | 884.157 |
Chemical Identifiers
| CAS Number | 5697-06-3 |
|---|---|
| SMILES | CC1=C(SC(=N1)C)C(=O)C2=C(C(=O)N(C2C3=CC=CS3)CCC[NH+](C)C)[O-] |
Product Overview
AC1NRNTZ (CAS 5697-06-3), with molecular formula C19H23N3O3S2 and molecular weight 405.11807 g/mol. IUPAC: 1-[3-(dimethylazaniumyl)propyl]-3-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-5-oxo-2-thiophen-2-yl-2H-pyrrol-4-olate.
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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