TL;DR: 6a-alpha-Noraporphin-9-ol, 6-benzyl-1,2,10-trimethoxy-, hydrochloride (CAS 101832-28-4) is a chemical compound with molecular formula C26H28ClNO4 and molecular weight 453.1707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6aS)-6-benzyl-1,2,11-trimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-10-ol chloride
Also Known As: 6-Benzyl-1,2,10-trimethoxy-6a-alpha-noraporphin-9-ol hydrochloride, 6a-alpha-NORAPORPHIN-9-OL, 6-BENZYL-1,2,10-TRIMETHOXY-, HYDROCHLORIDE, (6as)-6-benzyl-10-hydroxy-1,2,11-trimethoxy-5,6,6a,7-tetrahydro-4h-dibenzo[de,g]quinolinium chloride
| Molecular Formula | C26H28ClNO4 |
| Molecular Weight | 453.1707 g/mol |
| XLogP | 0.33 |
| Topological Polar Surface Area (TPSA) | 52.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.1707 Da |
| Heavy Atoms | 32 |
| Complexity | 596.0 |
| SMILES | COC1=C(C2=C3[C@H](CC4=C2C(=C(C=C4)O)OC)[NH+](CCC3=C1)CC5=CC=CC=C5)OC.[Cl-] |
| InChIKey | FJDLQOBSBIAHFC-FYZYNONXSA-N |
The XLogP value of 0.33 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6a-alpha-Noraporphin-9-ol, 6-benzyl-1,2,10-trimethoxy-, hydrochloride. With a topological polar surface area (TPSA) of 52.4 Ų, 6a-alpha-Noraporphin-9-ol, 6-benzyl-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-benzyl-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-benzyl-1,2,10-trimethoxy-, hydrochloride is 101832-28-4.
The molecular formula of 6a-alpha-Noraporphin-9-ol, 6-benzyl-1,2,10-trimethoxy-, hydrochloride is C26H28ClNO4.
The molecular weight of 6a-alpha-Noraporphin-9-ol, 6-benzyl-1,2,10-trimethoxy-, hydrochloride is 453.1707 g/mol.
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