TL;DR: 2-Hydroxypropanoic acid--6'-methoxycinchonan-9-ol (1/1) (CAS 10453-16-4) is a chemical compound with molecular formula C23H30N2O5 and molecular weight 414.21548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;2-hydroxypropanoic acid
Also Known As: Quinidine lactate, QUININE, MONOLACTATE (SALT), (9S)-6'-methoxycinchonan-9-ol 2-hydroxypropanoate (salt), 2-Hydroxypropanoic acid--6'-methoxycinchonan-9-ol (1/1), Cinchonan-9-ol, 6'-methoxy-, (9S)-, 2-hydroxypropanoate (salt)
| Molecular Formula | C23H30N2O5 |
| Molecular Weight | 414.21548 g/mol |
| XLogP | 2.63 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.21548 Da |
| Heavy Atoms | 30 |
| Complexity | 516.0 |
| SMILES | CC(C(=O)O)O.COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O |
| InChIKey | ZIDGEHZBXVXPFQ-KYNMMFKBSA-N |
The XLogP value of 2.63 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxypropanoic acid--6'-methoxycinchonan-9-ol (1/1). The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxypropanoic acid--6'-methoxycinchonan-9-ol (1/1). Following Lipinski's Rule of Five, 2-Hydroxypropanoic acid--6'-methoxycinchonan-9-ol (1/1) has 3 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 2-Hydroxypropanoic acid--6'-methoxycinchonan-9-ol (1/1) is 10453-16-4.
The molecular formula of 2-Hydroxypropanoic acid--6'-methoxycinchonan-9-ol (1/1) is C23H30N2O5.
The molecular weight of 2-Hydroxypropanoic acid--6'-methoxycinchonan-9-ol (1/1) is 414.21548 g/mol.
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