AC1NDH3Q
[4-[3-methoxy-3-oxo-2-(3-oxo-1H-isoindol-2-yl)propyl]phenyl] 2-chlorobenzoate
Also Known As: Oprea1_649082|KS-000034PA|2R-0647|4-[3-methoxy-3-oxo-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propyl]phenyl 2-chlorobenzenecarboxylate|[4-[3-methoxy-3-oxo-2-(3-oxo-1H-isoindol-2-yl)propyl]phenyl] 2-chlorobenzoate|4-[3-methoxy-3-oxo-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propyl]phenyl 2-chlorobenzoate|4-[3-methoxy-3-oxo-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propyl]phenyl2-chlorobenzoate
| Molecular Formula | C25H20ClNO5 |
|---|---|
| Molecular Weight | 449.103 g/mol |
| LogP | 4.2993 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 449.103 |
| Monoisotopic Mass | 449.103 |
| Heavy Atoms | 32 |
| Complexity | 1174.9596 |
Chemical Identifiers
| CAS Number | 477889-71-7 |
|---|---|
| SMILES | COC(=O)C(CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2Cl)N3CC4=CC=CC=C4C3=O |
Product Overview
AC1NDH3Q (CAS 477889-71-7), with molecular formula C25H20ClNO5 and molecular weight 449.103 g/mol. IUPAC: [4-[3-methoxy-3-oxo-2-(3-oxo-1H-isoindol-2-yl)propyl]phenyl] 2-chlorobenzoate.
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