TL;DR: Chlornidine (CAS 26389-78-6) is a chemical compound with molecular formula C11H13Cl2N3O4 and molecular weight 321.02832 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-bis(2-chloroethyl)-4-methyl-2,6-dinitroaniline
Also Known As: Torpedo, CHLORNIDINE, N,N-Bis(2-chloroethyl)-4-methyl-2,6-dinitroaniline, AN 5647, AI3-62692
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H13Cl2N3O4 |
| Molecular Weight | 321.02832 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 94.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.02832 Da |
| Heavy Atoms | 20 |
| Complexity | 318.0 |
| SMILES | CC1=CC(=C(C(=C1)[N+](=O)[O-])N(CCCl)CCCl)[N+](=O)[O-] |
| InChIKey | XKUWFOYPQIVFMM-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that Chlornidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Chlornidine. Following Lipinski's Rule of Five, Chlornidine has 0 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 Chlornidine is 26389-78-6.
The molecular formula of Chlornidine is C11H13Cl2N3O4.
The molecular weight of Chlornidine is 321.02832 g/mol.
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