AC1MFE9S
methyl 2-[2-(2-fluorophenyl)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Oprea1_756324|UPCMLD0ENAT5967454:001|methyl 2-(2-(2-fluorophenyl)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate|methyl 2-[2-(2-fluorophenyl)-4-hydroxy-5-oxo-3-(thiophen-2-ylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate|methyl 2-[2-(2-fluorophenyl)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate|methyl 2-[5-(2-fluorophenyl)-3-hydroxy-2-oxo-4-(2-thienylcarbonyl)(3-pyrroliny l)]-4-methyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C21H15FN2O5S2 |
|---|---|
| Molecular Weight | 458.04065 g/mol |
| LogP | 4.22162 |
| Topological Polar Surface Area | 96.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 458.04065 |
| Monoisotopic Mass | 458.04065 |
| Heavy Atoms | 31 |
| Complexity | 1232.3882 |
Chemical Identifiers
| CAS Number | 433258-65-2 |
|---|---|
| SMILES | CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=CC=C4F)C(=O)OC |
Product Overview
AC1MFE9S (CAS 433258-65-2), with molecular formula C21H15FN2O5S2 and molecular weight 458.04065 g/mol. IUPAC: methyl 2-[2-(2-fluorophenyl)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.