TL;DR: 2-Chloro-5-[(4-chlorophenyl)sulfonyl]aniline (CAS 141211-88-3) is a chemical compound with molecular formula C12H9Cl2NO2S and molecular weight 300.9731 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-5-(4-chlorophenyl)sulfonylaniline
Also Known As: 2-chloro-5-[(4-chlorophenyl)sulfonyl]aniline, 2-chloro-5-(4-chlorophenyl)sulfonylaniline, BAS 00327328, 2-chloro-5-((4-chlorophenyl)sulfonyl)aniline, AB00074908-01
| Molecular Formula | C12H9Cl2NO2S |
| Molecular Weight | 300.9731 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.9731 Da |
| Heavy Atoms | 18 |
| Complexity | 374.0 |
| SMILES | C1=CC(=CC=C1S(=O)(=O)C2=CC(=C(C=C2)Cl)N)Cl |
| InChIKey | WLLOCTOTEPGFAA-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 2-Chloro-5-[(4-chlorophenyl)sulfonyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5-[(4-chlorophenyl)sulfonyl]aniline. Following Lipinski's Rule of Five, 2-Chloro-5-[(4-chlorophenyl)sulfonyl]aniline has 1 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 2-Chloro-5-[(4-chlorophenyl)sulfonyl]aniline is 141211-88-3.
The molecular formula of 2-Chloro-5-[(4-chlorophenyl)sulfonyl]aniline is C12H9Cl2NO2S.
The molecular weight of 2-Chloro-5-[(4-chlorophenyl)sulfonyl]aniline is 300.9731 g/mol.
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