TL;DR: Mavoglurant (CAS 1636881-61-2) is a chemical compound with molecular formula C19H23NO3 and molecular weight 313.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (3aR,4S,7aR)-4-hydroxy-4-[2-(3-methylphenyl)ethynyl]-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate
Also Known As: Mavoglurant, Mavoglurant racemate, AFQ056, mavoglurantum, Mavoglurant [INN]
| Molecular Formula | C19H23NO3 |
| Molecular Weight | 313.1678 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.1678 Da |
| Heavy Atoms | 23 |
| Complexity | 519.0 |
| SMILES | CC1=CC(=CC=C1)C#C[C@@]2(CCC[C@@H]3[C@H]2CCN3C(=O)OC)O |
| InChIKey | ZFPZEYHRWGMJCV-ZHALLVOQSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mavoglurant. With a topological polar surface area (TPSA) of 49.8 Ų, Mavoglurant exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mavoglurant has 1 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 Mavoglurant is 1636881-61-2.
The molecular formula of Mavoglurant is C19H23NO3.
The molecular weight of Mavoglurant is 313.1678 g/mol.
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