TL;DR: 3-Chloro-N-(4-chlorophenyl)propanamide (CAS 19314-16-0) is a chemical compound with molecular formula C9H9Cl2NO and molecular weight 217.00612 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-N-(4-chlorophenyl)propanamide
Also Known As: 3-chloro-N-(4-chlorophenyl)propanamide, Not availabe, 3-Chloro-N-(4-chloro-phenyl)-propionamide, Propionanilide, 3,4'-dichloro-, 3-chloro-n-(4-chlorophenyl)propionamide
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H9Cl2NO |
| Molecular Weight | 217.00612 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.00612 Da |
| Heavy Atoms | 13 |
| Complexity | 167.0 |
| SMILES | C1=CC(=CC=C1NC(=O)CCCl)Cl |
| InChIKey | XHQYWNFRAYYHIT-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-N-(4-chlorophenyl)propanamide. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Chloro-N-(4-chlorophenyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-N-(4-chlorophenyl)propanamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Chloro-N-(4-chlorophenyl)propanamide is 19314-16-0.
The molecular formula of 3-Chloro-N-(4-chlorophenyl)propanamide is C9H9Cl2NO.
The molecular weight of 3-Chloro-N-(4-chlorophenyl)propanamide is 217.00612 g/mol.
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