TL;DR: Synerazol (CAS 127941-81-5) is a chemical compound with molecular formula C22H23NO7 and molecular weight 413.14746 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-benzoyl-2-[3-[(E)-but-1-enyl]oxiran-2-yl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione
Also Known As: Synerazol, 8-benzoyl-2-[3-[(E)-but-1-enyl]oxiran-2-yl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione, 1-Oxa-7-azaspiro(4.4)non-2-ene-4,6-dione, 8-benzoyl-2-(3-(1-butenyl)oxiranyl)-9-hydroxy-8-methoxy-3-methyl-, 2-benzoyl-8-[3-[(E)-but-1-enyl]oxiran-2-yl]-1-hydroxy-2-methoxy-7-methyl-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
| Molecular Formula | C22H23NO7 |
| Molecular Weight | 413.14746 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.14746 Da |
| Heavy Atoms | 30 |
| Complexity | 827.0 |
| SMILES | CC/C=C/C1C(O1)C2=C(C(=O)C3(O2)C(C(NC3=O)(C(=O)C4=CC=CC=C4)OC)O)C |
| InChIKey | UCUHTBUWKCQZNJ-VZUCSPMQSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Synerazol. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Synerazol. Following Lipinski's Rule of Five, Synerazol has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Synerazol is 127941-81-5.
The molecular formula of Synerazol is C22H23NO7.
The molecular weight of Synerazol is 413.14746 g/mol.
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