TL;DR: Berbine, 2,3,10-trimethoxy-(7CI,8CI) (CAS 16676-42-9) is a chemical compound with molecular formula C20H23NO3 and molecular weight 325.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,10-trimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
Also Known As: 2,3,10-Trimethoxyberbine, Berbine, 2,3,10-trimethoxy-, Berbine, 2,3,10-trimethoxy- (7CI,8CI), Berbine, 2,3,10-trimethoxy-(7CI,8CI), 5,8,13,13a-Tetrahydro-2,3,10-trimethoxy-6H-dibenzo(a,g)quinolizine
| Molecular Formula | C20H23NO3 |
| Molecular Weight | 325.1678 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 30.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.1678 Da |
| Heavy Atoms | 24 |
| Complexity | 431.0 |
| SMILES | COC1=CC2=C(CC3C4=CC(=C(C=C4CCN3C2)OC)OC)C=C1 |
| InChIKey | PTCKGHZCUIQESU-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that Berbine, 2,3,10-trimethoxy-(7CI,8CI) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.9 Ų, Berbine, 2,3,10-trimethoxy-(7CI,8CI) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Berbine, 2,3,10-trimethoxy-(7CI,8CI) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Berbine, 2,3,10-trimethoxy-(7CI,8CI) is 16676-42-9.
The molecular formula of Berbine, 2,3,10-trimethoxy-(7CI,8CI) is C20H23NO3.
The molecular weight of Berbine, 2,3,10-trimethoxy-(7CI,8CI) is 325.1678 g/mol.
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