TL;DR: 8-Methyl-7-nitroquinoline (CAS 168770-38-5) is a chemical compound with molecular formula C10H8N2O2 and molecular weight 188.05858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-methyl-7-nitroquinoline
Also Known As: 8-methyl-7-nitroquinoline, 8-Methyl-7-nitro-quinoline, Quinoline, 8-methyl-7-nitro-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H8N2O2 |
| Molecular Weight | 188.05858 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 58.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.05858 Da |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
| SMILES | CC1=C(C=CC2=C1N=CC=C2)[N+](=O)[O-] |
| InChIKey | BWCVXKXBFAYIEM-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Methyl-7-nitroquinoline. With a topological polar surface area (TPSA) of 58.7 Ų, 8-Methyl-7-nitroquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Methyl-7-nitroquinoline 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 8-Methyl-7-nitroquinoline is 168770-38-5.
The molecular formula of 8-Methyl-7-nitroquinoline is C10H8N2O2.
The molecular weight of 8-Methyl-7-nitroquinoline is 188.05858 g/mol.
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