AC1O0D4U
ethyl 4-[(E)-[2-(3-chlorophenyl)-1-(3-imidazol-1-ylpropyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Also Known As: ethyl 4-(1-(3-(1H-imidazol-1-yl)propyl)-2-(3-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate|ethyl 4-[(E)-[2-(3-chlorophenyl)-1-(3-imidazol-1-ylpropyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
| Molecular Formula | C26H27ClN4O5 |
|---|---|
| Molecular Weight | 510.167 g/mol |
| LogP | 4.17014 |
| Topological Polar Surface Area | 117.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 510.167 |
| Monoisotopic Mass | 510.167 |
| Heavy Atoms | 36 |
| Complexity | 1342.3041 |
Chemical Identifiers
| CAS Number | 848741-71-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=C(N1)C)/C(=C\2/C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC(=CC=C4)Cl)/O)C |
Product Overview
AC1O0D4U (CAS 848741-71-9), with molecular formula C26H27ClN4O5 and molecular weight 510.167 g/mol. IUPAC: ethyl 4-[(E)-[2-(3-chlorophenyl)-1-(3-imidazol-1-ylpropyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate.
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