![1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid structure](/static/products/1185/1185113-25-0.webp)
1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid
TL;DR: 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid (CAS 1185113-25-0) is a chemical compound with molecular formula C22H27N3O7 and molecular weight 445.1849 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid
Also Known As: 1-benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid, 1-benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine oxalate, 1-benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine; oxalic acid, IUPAC: 1-benzyl-4-[2-(3-methyl-4-nitro-phenoxy)ethyl]piperazine; Oxalic Acid, Piperazine, 1-[2-(3-methyl-4-nitrophenoxy)ethyl]-4-(phenylmethyl)-, ethanedioate (1:1)
Technical Specifications
| Molecular Formula | C22H27N3O7 |
| Molecular Weight | 445.1849 g/mol |
| XLogP | 2.25542 |
| Topological Polar Surface Area (TPSA) | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.1849 Da |
| Heavy Atoms | 32 |
| Complexity | 500.0 |
| SMILES | CC1=C(C=CC(=C1)OCCN2CCN(CC2)CC3=CC=CC=C3)[N+](=O)[O-].C(=O)(C(=O)O)O |
| InChIKey | LHENKOFPYHZXMJ-UHFFFAOYSA-N |
Chemical Property Profile of 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid
Property Insights of 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid
The XLogP value of 2.25542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid. Following Lipinski's Rule of Five, 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid?
The CAS number of 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid is 1185113-25-0.
What is the molecular formula of 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid?
The molecular formula of 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid is C22H27N3O7.
What is the molecular weight of 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid?
The molecular weight of 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid is 445.1849 g/mol.
Where can I buy 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid?
You can request a quote for 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid?
Yes, CoreyChem provides custom synthesis services for 1-Benzyl-4-[2-(3-methyl-4-nitrophenoxy)ethyl]piperazine;oxalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.