AC1NRBNY
2-chloro-5-[5-[(6-ethoxycarbonyl-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoate
Also Known As: 2-Chloro-5-(5-{[6-(ethoxycarbonyl)-7-methyl-3-oxo-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoate|2-chloro-5-[5-[(6-ethoxycarbonyl-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoate
| Molecular Formula | C26H18ClN2O6S2- |
|---|---|
| Molecular Weight | 553.0295 g/mol |
| LogP | 3.1367 |
| Topological Polar Surface Area | 113.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 553.0295 |
| Monoisotopic Mass | 553.0295 |
| Heavy Atoms | 37 |
| Complexity | 1743.5897 |
Chemical Identifiers
| CAS Number | 6829-99-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC=C(O4)C5=CC(=C(C=C5)Cl)C(=O)[O-])S2)C |
Product Overview
AC1NRBNY (CAS 6829-99-8), with molecular formula C26H18ClN2O6S2- and molecular weight 553.0295 g/mol. IUPAC: 2-chloro-5-[5-[(6-ethoxycarbonyl-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoate.
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