TL;DR: 3-(4-Chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}propanoic acid (CAS 1214100-62-5) is a chemical compound with molecular formula C15H13Cl2NO4S and molecular weight 372.99423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-chlorophenyl)-2-[(4-chlorophenyl)sulfonylamino]propanoic acid
Also Known As: EiM07-30013, 3-(4-chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}propanoic acid, BAS 02235599, 11G-322S, 2-(4-chlorobenzenesulfonamido)-3-(4-chlorophenyl)propanoic acid
| Molecular Formula | C15H13Cl2NO4S |
| Molecular Weight | 372.99423 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.99423 Da |
| Heavy Atoms | 23 |
| Complexity | 492.0 |
| SMILES | C1=CC(=CC=C1CC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl)Cl |
| InChIKey | MBKIFDZRLANKGM-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 3-(4-Chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}propanoic acid. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}propanoic acid 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 3-(4-Chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}propanoic acid is 1214100-62-5.
The molecular formula of 3-(4-Chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}propanoic acid is C15H13Cl2NO4S.
The molecular weight of 3-(4-Chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}propanoic acid is 372.99423 g/mol.
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