TL;DR: N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]acetamide (CAS 1008965-08-9) 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.
N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]acetamide
Also Known As: N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]acetamide, N-(3-chlorophenyl)-2-{1-[(3-methylphenyl)carbonyl]-3-oxopiperazin-2-yl}acetamide, N-(3-chlorophenyl)-2-(1-(3-methylbenzoyl)-3-oxopiperazin-2-yl)acetamide, N-(3-chlorophenyl)-2-{1-[(3-methylphenyl)carbonyl]-3-oxopiperazin-2-yl}acetami de, N~1~-(3-CHLOROPHENYL)-2-[1-(3-METHYLBENZOYL)-3-OXO-2-PIPERAZINYL]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=C1)C(=O)N2CCNC(=O)C2CC(=O)NC3=CC(=CC=C3)Cl |
| InChIKey | JZHPSJSYQOAEHL-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]acetamide. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]acetamide. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]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 N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]acetamide is 1008965-08-9.
The molecular formula of N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]acetamide is C20H20ClN3O3.
The molecular weight of N-(3-chlorophenyl)-2-[1-(3-methylbenzoyl)-3-oxopiperazin-2-yl]acetamide is 385.11932 g/mol.
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