AC1MFERD
ethyl 2-[4-hydroxy-5-oxo-2-phenyl-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Oprea1_720941|UPCMLD0ENAT5967558:001|ethyl 2-(3-hydroxy-2-oxo-5-phenyl-4-(thiophene-2-carbonyl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate|ethyl 2-[3-hydroxy-2-oxo-5-phenyl-4-(2-thienylcarbonyl)(3-pyrrolinyl)]-4-methy l-1,3-thiazole-5-carboxylate|ethyl 2-[3-hydroxy-2-oxo-5-phenyl-4-(thiophen-2-ylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate|ethyl 2-[4-hydroxy-5-oxo-2-phenyl-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C22H18N2O5S2 |
|---|---|
| Molecular Weight | 454.0657 g/mol |
| LogP | 4.47262 |
| Topological Polar Surface Area | 96.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.0657 |
| Monoisotopic Mass | 454.0657 |
| Heavy Atoms | 31 |
| Complexity | 1181.9741 |
Chemical Identifiers
| CAS Number | 433261-83-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=CC=C4)C |
Product Overview
AC1MFERD (CAS 433261-83-7), with molecular formula C22H18N2O5S2 and molecular weight 454.0657 g/mol. IUPAC: ethyl 2-[4-hydroxy-5-oxo-2-phenyl-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.