TL;DR: SDZ-BOP 086 maleate (CAS 104925-23-7) is a chemical compound with molecular formula C13H21NO6 and molecular weight 287.1369 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-but-2-enedioic acid;(2S)-2,8-dimethyl-1,3-dioxa-8-azaspiro[4.5]decane
Also Known As: SDZ-BOP 086 maleate, SDZ 210-086 maleate, 1,3-Dioxa-8-azaspiro[4.5]decane, 2,8-dimethyl-, (2S)-, (2Z)-2-butenedioate (1:1), 1,3-Dioxa-8-azaspiro[4.5]decane, 2,8-dimethyl-, (S)-, (Z)-2-butenedioate (1:1), IUPAC: But-2-enedioic Acid; (2S)-2,8-dimethyl-1,3-dioxa-8-azaspiro[4.5]decane
| Molecular Formula | C13H21NO6 |
| Molecular Weight | 287.1369 g/mol |
| XLogP | 0.5554 |
| Topological Polar Surface Area (TPSA) | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.1369 Da |
| Heavy Atoms | 20 |
| Complexity | 283.0 |
| SMILES | C[C@H]1OCC2(O1)CCN(CC2)C.C(=C\C(=O)O)\C(=O)O |
| InChIKey | PVFRMGTXCHOGOM-KZDSSNOQSA-N |
The XLogP value of 0.5554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SDZ-BOP 086 maleate. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for SDZ-BOP 086 maleate. Following Lipinski's Rule of Five, SDZ-BOP 086 maleate 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 SDZ-BOP 086 maleate is 104925-23-7.
The molecular formula of SDZ-BOP 086 maleate is C13H21NO6.
The molecular weight of SDZ-BOP 086 maleate is 287.1369 g/mol.
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