TL;DR: 6a-alpha-Noraporphin-9-ol, 6-isobutyl-1,2,10-trimethoxy-, hydrochloride (CAS 41431-43-0) is a chemical compound with molecular formula C23H30ClNO4 and molecular weight 419.18634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6aS)-1,2,11-trimethoxy-6-(2-methylpropyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-10-ol chloride
Also Known As: 6-Isobutyl-1,2,10-trimethoxy-6a-alpha-noraporphin-9-ol hydrochloride, 6a-alpha-NORAPORPHIN-9-OL, 6-ISOBUTYL-1,2,10-TRIMETHOXY-, HYDROCHLORIDE
| Molecular Formula | C23H30ClNO4 |
| Molecular Weight | 419.18634 g/mol |
| XLogP | -0.22 |
| Topological Polar Surface Area (TPSA) | 52.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.18634 Da |
| Heavy Atoms | 29 |
| Complexity | 529.0 |
| SMILES | CC(C)C[NH+]1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)O)OC)OC)OC.[Cl-] |
| InChIKey | KKCHMQPLKDTEDF-NTISSMGPSA-N |
The XLogP value of -0.22 indicates that 6a-alpha-Noraporphin-9-ol, 6-isobutyl-1,2,10-trimethoxy-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.4 Ų, 6a-alpha-Noraporphin-9-ol, 6-isobutyl-1,2,10-trimethoxy-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6a-alpha-Noraporphin-9-ol, 6-isobutyl-1,2,10-trimethoxy-, hydrochloride has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6a-alpha-Noraporphin-9-ol, 6-isobutyl-1,2,10-trimethoxy-, hydrochloride is 41431-43-0.
The molecular formula of 6a-alpha-Noraporphin-9-ol, 6-isobutyl-1,2,10-trimethoxy-, hydrochloride is C23H30ClNO4.
The molecular weight of 6a-alpha-Noraporphin-9-ol, 6-isobutyl-1,2,10-trimethoxy-, hydrochloride is 419.18634 g/mol.
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