AC1MGFUY
methyl 4-[3-(furan-2-carbonyl)-4-hydroxy-5-oxo-1-(oxolan-2-ylmethyl)-2H-pyrrol-2-yl]benzoate
Also Known As: BAS 05541667|AB00841951-04|methyl 4-[3-(furan-2-ylcarbonyl)-4-hydroxy-5-oxo-1-(tetrahydrofuran-2-ylmethyl)-2,5-dihydro-1H-pyrrol-2-yl]benzoate|4-[3-(Furan-2-carbonyl)-4-hydroxy-5-oxo-1-(tetrahydro-furan-2-ylmethyl)-2,5-dihydro-1H-pyrrol-2-yl]-benzoic acid methyl ester|Methyl 4-(3-(furan-2-carbonyl)-4-hydroxy-5-oxo-1-((tetrahydrofuran-2-yl)methyl)-2,5-dihydro-1H-pyrrol-2-yl)benzoate|methyl 4-[3-(2-furoyl)-4-hydroxy-5-oxo-1-(tetrahydro-2-furanylmethyl)-2,5-dihydro-1H-pyrrol-2-yl]benzoate|methyl 4-[3-(furan-2-carbonyl)-4-hydroxy-5-oxo-1-(oxolan-2-ylmethyl)-2H-pyrrol-2-yl]benzoate
| Molecular Formula | C22H21NO7 |
|---|---|
| Molecular Weight | 411.1318 g/mol |
| LogP | 2.8235 |
| Topological Polar Surface Area | 106.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.1318 |
| Monoisotopic Mass | 411.1318 |
| Heavy Atoms | 30 |
| Complexity | 985.0032 |
Chemical Identifiers
| CAS Number | 618072-40-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2C(=C(C(=O)N2CC3CCCO3)O)C(=O)C4=CC=CO4 |
Product Overview
AC1MGFUY (CAS 618072-40-5), with molecular formula C22H21NO7 and molecular weight 411.1318 g/mol. IUPAC: methyl 4-[3-(furan-2-carbonyl)-4-hydroxy-5-oxo-1-(oxolan-2-ylmethyl)-2H-pyrrol-2-yl]benzoate.
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