TL;DR: 2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide (CAS 1009240-65-6) is a chemical compound with molecular formula C20H20ClN3O3 and molecular weight 385.11932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide
Also Known As: 2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide, 2-(1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl)-N-(o-tolyl)acetamide, 2-{1-[(3-chlorophenyl)carbonyl]-3-oxopiperazin-2-yl}-N-(2-methylphenyl)acetamide
| Molecular Formula | C20H20ClN3O3 |
| Molecular Weight | 385.11932 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.11932 Da |
| Heavy Atoms | 27 |
| Complexity | 571.0 |
| SMILES | CC1=CC=CC=C1NC(=O)CC2C(=O)NCCN2C(=O)C3=CC(=CC=C3)Cl |
| InChIKey | MZVIMDOZWBTGOT-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide. Following Lipinski's Rule of Five, 2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide has 2 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-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide is 1009240-65-6.
The molecular formula of 2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide is C20H20ClN3O3.
The molecular weight of 2-[1-(3-chlorobenzoyl)-3-oxopiperazin-2-yl]-N-(2-methylphenyl)acetamide is 385.11932 g/mol.
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