TL;DR: cis-(+-)-1a,7b-Dihydro-4-methyloxireno(f)quinolinium (CAS 142044-37-9) is a chemical compound with molecular formula C10H10NO+ and molecular weight 160.07623 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1aR,7bS)-4-methyl-1a,7b-dihydrooxireno[2,3-f]quinolin-4-ium
Also Known As: N-Methyl-quinoline 5,6-oxide, N-Methyl-quinoline-5,6-oxide, cis-(+-)-1a,7b-Dihydro-4-methyloxireno(f)quinolinium, N-METHYL-QUINOLINE5,6-OXIDE, (1aR,7bS)-4-methyl-1a,7b-dihydrooxireno[2,3-f]quinolin-4-ium
| Molecular Formula | C10H10NO+ |
| Molecular Weight | 160.07623 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 16.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.07623 Da |
| Heavy Atoms | 12 |
| Complexity | 226.0 |
| SMILES | C[N+]1=CC=CC2=C1C=C[C@@H]3[C@H]2O3 |
| InChIKey | ONKBGDHSUHECFS-ZJUUUORDSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-(+-)-1a,7b-Dihydro-4-methyloxireno(f)quinolinium. With a topological polar surface area (TPSA) of 16.4 Ų, cis-(+-)-1a,7b-Dihydro-4-methyloxireno(f)quinolinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-(+-)-1a,7b-Dihydro-4-methyloxireno(f)quinolinium has 0 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 cis-(+-)-1a,7b-Dihydro-4-methyloxireno(f)quinolinium is 142044-37-9.
The molecular formula of cis-(+-)-1a,7b-Dihydro-4-methyloxireno(f)quinolinium is C10H10NO+.
The molecular weight of cis-(+-)-1a,7b-Dihydro-4-methyloxireno(f)quinolinium is 160.07623 g/mol.
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