TL;DR: ABP-688 C-11 Z-isomer (CAS 1632324-71-0) is a chemical compound with molecular formula C15H16N2O and molecular weight 239.1377 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-N-(111C)methoxy-3-[2-(6-methyl-2-pyridinyl)ethynyl]cyclohex-2-en-1-imine
Also Known As: ABP-688 C-11 Z-isomer, 2-Cyclohexen-1-one, 3-(2-(6-methyl-2-pyridinyl)ethynyl)-, O-(methyl-11C)oxime, (1Z)-, H29HO637KX
| Molecular Formula | C15H16N2O |
| Molecular Weight | 239.1377 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.1377 Da |
| Heavy Atoms | 18 |
| Complexity | 411.0 |
| SMILES | CC1=NC(=CC=C1)C#CC2=C/C(=N\O[11CH3])/CCC2 |
| InChIKey | CNNZLFXCUQLKOB-OWUFSHKGSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ABP-688 C-11 Z-isomer. With a topological polar surface area (TPSA) of 34.5 Ų, ABP-688 C-11 Z-isomer exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ABP-688 C-11 Z-isomer has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of ABP-688 C-11 Z-isomer is 1632324-71-0.
The molecular formula of ABP-688 C-11 Z-isomer is C15H16N2O.
The molecular weight of ABP-688 C-11 Z-isomer is 239.1377 g/mol.
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