TL;DR: Isoquinoline, 3,4-dihydro-5,6-dimethoxy- (CAS 103797-01-9) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,6-dimethoxy-3,4-dihydroisoquinoline
Also Known As: Isoquinoline, 3,4-dihydro-5,6-dimethoxy-, 5,6-dimethoxy-3,4-dihydroisoquinoline
| Molecular Formula | C11H13NO2 |
| Molecular Weight | 191.09464 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 30.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.09464 Da |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
| SMILES | COC1=C(C2=C(C=C1)C=NCC2)OC |
| InChIKey | HCIZYEJDPMPNBF-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoquinoline, 3,4-dihydro-5,6-dimethoxy-. With a topological polar surface area (TPSA) of 30.8 Ų, Isoquinoline, 3,4-dihydro-5,6-dimethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 3,4-dihydro-5,6-dimethoxy- has 0 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 Isoquinoline, 3,4-dihydro-5,6-dimethoxy- is 103797-01-9.
The molecular formula of Isoquinoline, 3,4-dihydro-5,6-dimethoxy- is C11H13NO2.
The molecular weight of Isoquinoline, 3,4-dihydro-5,6-dimethoxy- is 191.09464 g/mol.
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