N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide
TL;DR: N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide (CAS 1009501-28-3) is a chemical compound with molecular formula C13H16ClN3O2 and molecular weight 281.0931 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide
Also Known As: CBKinase1_005418, CBKinase1_017818, N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide, BAS 07100521, AJ-292/42284892
Technical Specifications
| Molecular Formula | C13H16ClN3O2 |
| Molecular Weight | 281.0931 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.0931 Da |
| Heavy Atoms | 19 |
| Complexity | 351.0 |
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)CC2C(=O)NCCN2 |
| InChIKey | HCLQSVITHNJPCQ-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide
Property Insights of N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-2-methylphenyl)-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-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide. Following Lipinski's Rule of Five, N-(3-chloro-2-methylphenyl)-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.
Frequently Asked Questions
What is the CAS number of N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The CAS number of N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide is 1009501-28-3.
What is the molecular formula of N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The molecular formula of N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide is C13H16ClN3O2.
What is the molecular weight of N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The molecular weight of N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide is 281.0931 g/mol.
Where can I buy N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
You can request a quote for N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for N-(3-chloro-2-methylphenyl)-2-(3-oxopiperazin-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.