TL;DR: 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-8-methyl-, hydrochloride (CAS 101077-25-2) is a chemical compound with molecular formula C13H18ClN and molecular weight 223.11278 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene;hydrochloride
Also Known As: 8-Methyljulolidine hydrochloride, C13N17N.ClH, 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-8-methyl-, hydrochloride, 2,3,6,7-Tetrahydro-8-methyl-1H,5H-benzo(ij)quinolizine hydrochloride, 8-Methyl-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline--hydrogen chloride (1/1)
| Molecular Formula | C13H18ClN |
| Molecular Weight | 223.11278 g/mol |
| XLogP | 3.11562 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 223.11278 Da |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
| SMILES | CC1=C2CCCN3C2=C(CCC3)C=C1.Cl |
| InChIKey | DCMRGBSVWSMSQZ-UHFFFAOYSA-N |
The XLogP value of 3.11562 indicates that 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-8-methyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-8-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-8-methyl-, hydrochloride has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-8-methyl-, hydrochloride is 101077-25-2.
The molecular formula of 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-8-methyl-, hydrochloride is C13H18ClN.
The molecular weight of 1H,5H-Benzo(ij)quinolizine, 2,3,6,7-tetrahydro-8-methyl-, hydrochloride is 223.11278 g/mol.
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