2-(4-Isobutylpiperazin-1-yl)acetic acid
TL;DR: 2-(4-Isobutylpiperazin-1-yl)acetic acid (CAS 896523-61-8) is a chemical compound with molecular formula C10H20N2O2 and molecular weight 200.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-methylpropyl)piperazin-1-yl]acetic acid
Also Known As: 2-(4-isobutylpiperazin-1-yl)acetic acid, 1-Piperazineaceticacid, 4-(2-methylpropyl)-, 2-[4-(2-methylpropyl)piperazin-1-yl]acetic Acid, (4-Isobutyl-piperazin-1-yl)-acetic acid 2HCl salt, A1-52754
| Molecular Formula | C10H20N2O2 |
|---|---|
| Molecular Weight | 200.15 g/mol |
| LogP | 0.3446 |
| Topological Polar Surface Area | 43.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.15248 |
| Heavy Atoms | 14 |
| Complexity | 186.56102 |
Chemical Identifiers
| CAS Number | 896523-61-8 |
|---|---|
| SMILES | CC(C)CN1CCN(CC1)CC(=O)O |
Product Overview
2-(4-Isobutylpiperazin-1-yl)acetic acid (CAS 896523-61-8), with molecular formula C10H20N2O2 and molecular weight 200.15 g/mol. IUPAC: 2-[4-(2-methylpropyl)piperazin-1-yl]acetic acid.
Chemical Property Profile of 2-(4-Isobutylpiperazin-1-yl)acetic acid
Property Insights of 2-(4-Isobutylpiperazin-1-yl)acetic acid
The XLogP value of 0.3446 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Isobutylpiperazin-1-yl)acetic acid. With a topological polar surface area (TPSA) of 43.78 Ų, 2-(4-Isobutylpiperazin-1-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Isobutylpiperazin-1-yl)acetic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-Isobutylpiperazin-1-yl)acetic acid?
The CAS number of 2-(4-Isobutylpiperazin-1-yl)acetic acid is 896523-61-8.
What is the molecular formula of 2-(4-Isobutylpiperazin-1-yl)acetic acid?
The molecular formula of 2-(4-Isobutylpiperazin-1-yl)acetic acid is C10H20N2O2.
What is the molecular weight of 2-(4-Isobutylpiperazin-1-yl)acetic acid?
The molecular weight of 2-(4-Isobutylpiperazin-1-yl)acetic acid is 200.15 g/mol.
Where can I buy 2-(4-Isobutylpiperazin-1-yl)acetic acid?
You can request a quote for 2-(4-Isobutylpiperazin-1-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Isobutylpiperazin-1-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Isobutylpiperazin-1-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.