AC1L4JQX
(1'-acetyl-5-hydroxyspiro[benzo[b][1]benzoxepine-6,4'-piperidine]-5-yl) acetate
Also Known As: 1'-acetyl-11-hydroxy-11H-spiro[dibenzo[b,f]oxepine-10,4'-piperidin]-11-yl acetate|Spiro(dibenz(b,f)oxepin-10(11H),4'-piperidine)-11,11-diol, 1'-acetyl-, monoacetate (ester)|(1'-acetyl-5-hydroxyspiro[benzo[b][1]benzoxepine-6,4'-piperidine]-5-yl) acetate|(1'-ethanoyl-5-oxidanyl-spiro[benzo[b][1]benzoxepine-6,4'-piperidine]-5-yl) ethanoate
| Molecular Formula | C22H23NO5 |
|---|---|
| Molecular Weight | 381.15762 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 381.15762 |
| Monoisotopic Mass | 381.15762 |
| Heavy Atoms | 28 |
| Complexity | 614.0 |
Chemical Identifiers
| CAS Number | 74403-82-0 |
|---|---|
| SMILES | CC(=O)N1CCC2(CC1)C3=CC=CC=C3OC4=CC=CC=C4C2(O)OC(=O)C |
| InChIKey | BHUZZRDATFGITA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
AC1L4JQX (CAS 74403-82-0), with molecular formula C22H23NO5 and molecular weight 381.15762 g/mol. IUPAC: (1'-acetyl-5-hydroxyspiro[benzo[b][1]benzoxepine-6,4'-piperidine]-5-yl) acetate.
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