TL;DR: 2-[(2,6-Dichloro-3-methylphenyl)amino]benzoate (CAS 168273-06-1) is a chemical compound with molecular formula C14H10Cl2NO2- and molecular weight 294.00885 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,6-dichloro-3-methylanilino)benzoate
Also Known As: meclofenamate, Meclomen, MECLODIUM, meclofenamic acid(1-), Meclofenamic acid sodium
| Molecular Formula | C14H10Cl2NO2- |
| Molecular Weight | 294.00885 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 52.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.00885 Da |
| Heavy Atoms | 19 |
| Complexity | 321.0 |
| SMILES | CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)[O-])Cl |
| InChIKey | SBDNJUWAMKYJOX-UHFFFAOYSA-M |
The XLogP value of 5.8 indicates that 2-[(2,6-Dichloro-3-methylphenyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.2 Ų, 2-[(2,6-Dichloro-3-methylphenyl)amino]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2,6-Dichloro-3-methylphenyl)amino]benzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-[(2,6-Dichloro-3-methylphenyl)amino]benzoate is 168273-06-1.
The molecular formula of 2-[(2,6-Dichloro-3-methylphenyl)amino]benzoate is C14H10Cl2NO2-.
The molecular weight of 2-[(2,6-Dichloro-3-methylphenyl)amino]benzoate is 294.00885 g/mol.
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