TL;DR: (-)-(5S,8R)-Lisuride (CAS 159701-44-7) is a chemical compound with molecular formula C20H26N4O and molecular weight 338.21066 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(6aS,9R)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]-1,1-diethylurea
Also Known As: Lysuride, (-)-(5S,8R)-Lisuride, Lopac-L-118, Lopac-L-122, Tox21_112019
| Molecular Formula | C20H26N4O |
| Molecular Weight | 338.21066 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 51.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.21066 Da |
| Heavy Atoms | 25 |
| Complexity | 544.0 |
| SMILES | CCN(CC)C(=O)N[C@H]1CN([C@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C |
| InChIKey | BKRGVLQUQGGVSM-KDOFPFPSSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (-)-(5S,8R)-Lisuride. With a topological polar surface area (TPSA) of 51.4 Ų, (-)-(5S,8R)-Lisuride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (-)-(5S,8R)-Lisuride has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (-)-(5S,8R)-Lisuride is 159701-44-7.
The molecular formula of (-)-(5S,8R)-Lisuride is C20H26N4O.
The molecular weight of (-)-(5S,8R)-Lisuride is 338.21066 g/mol.
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