Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide
TL;DR: Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide (CAS 111329-05-6) is a chemical compound with molecular formula C20H26IN3O2 and molecular weight 467.10696 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethyl-1-methyl-4-[(4-nitrophenyl)-phenylmethyl]piperazin-1-ium iodide
Also Known As: 1-Ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)piperazinium iodide, Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide, 1-Ethyl-1-methyl-4-[(4-nitrophenyl)(phenyl)methyl]piperazin-1-ium iodide, 1-ethyl-1-methyl-4-[(4-nitrophenyl)-phenylmethyl]piperazin-1-ium iodide
Technical Specifications
| Molecular Formula | C20H26IN3O2 |
| Molecular Weight | 467.10696 g/mol |
| XLogP | 0.4703 |
| Topological Polar Surface Area (TPSA) | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 467.10696 Da |
| Heavy Atoms | 26 |
| Complexity | 429.0 |
| SMILES | CC[N+]1(CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C.[I-] |
| InChIKey | MFFSFUUNIQLTPV-UHFFFAOYSA-M |
Chemical Property Profile of Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide
Property Insights of Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide
The XLogP value of 0.4703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide. With a topological polar surface area (TPSA) of 49.1 Ų, Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide?
The CAS number of Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide is 111329-05-6.
What is the molecular formula of Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide?
The molecular formula of Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide is C20H26IN3O2.
What is the molecular weight of Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide?
The molecular weight of Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide is 467.10696 g/mol.
Where can I buy Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide?
You can request a quote for Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide?
Yes, CoreyChem provides custom synthesis services for Piperazinium, 1-ethyl-1-methyl-4-(p-nitro-alpha-phenylbenzyl)-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.