2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid
TL;DR: 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid (CAS 549506-47-0) is a chemical compound with molecular formula C19H28N2O4 and molecular weight 348.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-phenylbutanoic acid
Also Known As: 2-(4-Boc-piperazinyl)-4-phenylbutanoic acid, 2-(4-(tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid, 2- -4-PHENYLBUTANOICACID, PCD-0-01, 4794AH
| Molecular Formula | C19H28N2O4 |
|---|---|
| Molecular Weight | 348.20 g/mol |
| LogP | 2.6251 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.2049 |
| Heavy Atoms | 25 |
| Complexity | 574.8369 |
Chemical Identifiers
| CAS Number | 549506-47-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCN(CC1)C(CCC2=CC=CC=C2)C(=O)O |
Product Overview
2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid (CAS 549506-47-0), with molecular formula C19H28N2O4 and molecular weight 348.20 g/mol. IUPAC: 2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-phenylbutanoic acid.
Chemical Property Profile of 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid
Property Insights of 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid
The XLogP value of 2.6251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid. Following Lipinski's Rule of Five, 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid has 1 hydrogen bond donor(s) and 4 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-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid?
The CAS number of 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid is 549506-47-0.
What is the molecular formula of 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid?
The molecular formula of 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid is C19H28N2O4.
What is the molecular weight of 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid?
The molecular weight of 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid is 348.20 g/mol.
Where can I buy 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid?
You can request a quote for 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic 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-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.