TL;DR: Apraclonidine (CAS 66711-21-5) is a chemical compound with molecular formula C9H10Cl2N4 and molecular weight 244.02826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dichloro-1-N-(4,5-dihydro-1H-imidazol-2-yl)benzene-1,4-diamine
Also Known As: apraclonidine, Aplonidine, Apraclonidina, Iopidine, 4-Aminoclonidine
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H10Cl2N4 |
| Molecular Weight | 244.02826 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 62.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.02826 Da |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
| Solubility | 4.09e-01 g/L |
| SMILES | C1CN=C(N1)NC2=C(C=C(C=C2Cl)N)Cl |
| InChIKey | IEJXVRYNEISIKR-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Apraclonidine. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Apraclonidine. Following Lipinski's Rule of Five, Apraclonidine has 3 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 Apraclonidine is 66711-21-5.
The molecular formula of Apraclonidine is C9H10Cl2N4.
The molecular weight of Apraclonidine is 244.02826 g/mol.
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