TL;DR: N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide (CAS 1007938-38-6) is a chemical compound with molecular formula C12H13Cl2N3O2 and molecular weight 301.03848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide
Also Known As: N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide, N-(3,4-Dichloro-phenyl)-2-(3-oxo-piperazin-2-yl)-acetamide
| Molecular Formula | C12H13Cl2N3O2 |
| Molecular Weight | 301.03848 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.03848 Da |
| Heavy Atoms | 19 |
| Complexity | 354.0 |
| SMILES | C1CNC(=O)C(N1)CC(=O)NC2=CC(=C(C=C2)Cl)Cl |
| InChIKey | JPTBGIHCKDTFGU-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide. Following Lipinski's Rule of Five, N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide has 3 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 N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide is 1007938-38-6.
The molecular formula of N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide is C12H13Cl2N3O2.
The molecular weight of N-(3,4-dichlorophenyl)-2-(3-oxopiperazin-2-yl)acetamide is 301.03848 g/mol.
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