Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester
TL;DR: Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester (CAS 111560-48-6) is a chemical compound with molecular formula C19H37IN2O2 and molecular weight 452.18997 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-methyl-4-undec-10-enylpiperazin-4-ium-1-carboxylate iodide
Also Known As: 4-Carboxy-1-methyl-1-(10-undecenyl)piperazinium iodide ethyl ester, Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester, ethyl 4-methyl-4-undec-10-enylpiperazin-4-ium-1-carboxylate iodide, ethyl 4-methyl-4-undec-10-enylpiperazin-4-ium-1-carboxylate;iodide, ethyl 4-methyl-4-undec-10-enyl-2,3,5,6-tetrahydropyrazine-1-carboxylat e iodide
Technical Specifications
| Molecular Formula | C19H37IN2O2 |
| Molecular Weight | 452.18997 g/mol |
| XLogP | 1.2159 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 452.18997 Da |
| Heavy Atoms | 24 |
| Complexity | 336.0 |
| SMILES | CCOC(=O)N1CC[N+](CC1)(C)CCCCCCCCCC=C.[I-] |
| InChIKey | VWMYXHGPBKEULF-UHFFFAOYSA-M |
Chemical Property Profile of Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester
Property Insights of Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester
The XLogP value of 1.2159 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester. With a topological polar surface area (TPSA) of 29.5 Ų, Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester has 0 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 Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester?
The CAS number of Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester is 111560-48-6.
What is the molecular formula of Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester?
The molecular formula of Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester is C19H37IN2O2.
What is the molecular weight of Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester?
The molecular weight of Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester is 452.18997 g/mol.
Where can I buy Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester?
You can request a quote for Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Piperazinium, 4-carboxy-1-methyl-1-(10-undecenyl)-, iodide, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.