N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide
TL;DR: N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide (CAS 1008069-42-8) is a chemical compound with molecular formula C12H14N4O4 and molecular weight 278.1015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide
Also Known As: N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide, CBKinase1_006624, CBKinase1_019024, VU0507630-1, BRD-A62705044-001-01-2
Technical Specifications
| Molecular Formula | C12H14N4O4 |
| Molecular Weight | 278.1015 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.1015 Da |
| Heavy Atoms | 20 |
| Complexity | 395.0 |
| SMILES | C1CNC(=O)C(N1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | RBOCNWCDURNZFQ-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide
Property Insights of N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide
The XLogP value of -0.4 indicates that N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide. Following Lipinski's Rule of Five, N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide has 3 hydrogen bond donor(s) and 5 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-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The CAS number of N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide is 1008069-42-8.
What is the molecular formula of N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The molecular formula of N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide is C12H14N4O4.
What is the molecular weight of N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The molecular weight of N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide is 278.1015 g/mol.
Where can I buy N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide?
You can request a quote for N-(3-nitrophenyl)-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-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for N-(3-nitrophenyl)-2-(3-oxopiperazin-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.