TL;DR: 9-(2-(2-Nitro-1-imidazolyl)ethylamino)acridine (CAS 142618-00-6) is a chemical compound with molecular formula C18H16ClN5O2 and molecular weight 369.09924 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(2-nitroimidazol-1-yl)ethyl]acridin-9-amine;hydrochloride
Also Known As: NLA 2, 9-(2-(2-Nitro-1-imidazolyl)ethylamino)acridine, N-(2-(2-Nitro-1H-imidazol-1-yl)ethyl)-9-acridinamine monohydrochloride, 9-Acridinamine, N-(2-(2-nitro-1H-imidazol-1-yl)ethyl)-, monohydrochloride, N-[2-(2-nitroimidazol-1-yl)ethyl]acridin-9-amine hydrochloride
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H16ClN5O2 |
| Molecular Weight | 369.09924 g/mol |
| XLogP | 4.0266 |
| Topological Polar Surface Area (TPSA) | 88.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.09924 Da |
| Heavy Atoms | 26 |
| Complexity | 449.0 |
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCN4C=CN=C4[N+](=O)[O-].Cl |
| InChIKey | MQLFCIAPVUBEAY-UHFFFAOYSA-N |
The XLogP value of 4.0266 indicates that 9-(2-(2-Nitro-1-imidazolyl)ethylamino)acridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(2-(2-Nitro-1-imidazolyl)ethylamino)acridine. Following Lipinski's Rule of Five, 9-(2-(2-Nitro-1-imidazolyl)ethylamino)acridine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 9-(2-(2-Nitro-1-imidazolyl)ethylamino)acridine is 142618-00-6.
The molecular formula of 9-(2-(2-Nitro-1-imidazolyl)ethylamino)acridine is C18H16ClN5O2.
The molecular weight of 9-(2-(2-Nitro-1-imidazolyl)ethylamino)acridine is 369.09924 g/mol.
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