TL;DR: 1H,5H-Benzo(ij)quinolizine-9-methanol, 2,3,6,7-tetrahydro- (CAS 101077-18-3) is a chemical compound with molecular formula C13H17NO and molecular weight 203.13101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethanol
Also Known As: 9-Hydroxymethyljulolidine, 1H,5H-Benzo(ij)quinolizine-9-methanol, 2,3,6,7-tetrahydro-, 4-21-00-00813 (Beilstein Handbook Reference), 2,3,6,7-Tetrahydro-1H,5H-benzo(ij)quinolizine-9-methanol, 2,3,6,7-Tetrahydro-1H,5H-benzo[ij]quinolizine-9-methanol
| Molecular Formula | C13H17NO |
| Molecular Weight | 203.13101 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.13101 Da |
| Heavy Atoms | 15 |
| Complexity | 211.0 |
| SMILES | C1CC2=CC(=CC3=C2N(C1)CCC3)CO |
| InChIKey | OTRHTQIEJBKBAT-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H,5H-Benzo(ij)quinolizine-9-methanol, 2,3,6,7-tetrahydro-. With a topological polar surface area (TPSA) of 23.5 Ų, 1H,5H-Benzo(ij)quinolizine-9-methanol, 2,3,6,7-tetrahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H,5H-Benzo(ij)quinolizine-9-methanol, 2,3,6,7-tetrahydro- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H,5H-Benzo(ij)quinolizine-9-methanol, 2,3,6,7-tetrahydro- is 101077-18-3.
The molecular formula of 1H,5H-Benzo(ij)quinolizine-9-methanol, 2,3,6,7-tetrahydro- is C13H17NO.
The molecular weight of 1H,5H-Benzo(ij)quinolizine-9-methanol, 2,3,6,7-tetrahydro- is 203.13101 g/mol.
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