1-Boc-4-(4-methoxycarbonylphenyl)piperazine
TL;DR: 1-Boc-4-(4-methoxycarbonylphenyl)piperazine (CAS 158985-36-5) is a chemical compound with molecular formula C17H24N2O4 and molecular weight 320.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 4-(4-methoxycarbonylphenyl)piperazine-1-carboxylate
Also Known As: 1-Boc-4-(4-methoxycarbonylphenyl)piperazine, tert-Butyl 4-(4-(methoxycarbonyl)phenyl)piperazine-1-carboxylate, 12-TRIDECYNOICACID, buttpark 99\06-01, tert-butyl 4-(4-methoxycarbonylphenyl)piperazine-1-carboxylate
| Molecular Formula | C17H24N2O4 |
|---|---|
| Molecular Weight | 320.17 g/mol |
| LogP | 2.5303 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.1736 |
| Heavy Atoms | 23 |
| Complexity | 554.95123 |
Chemical Identifiers
| CAS Number | 158985-36-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)OC |
Product Overview
1-Boc-4-(4-methoxycarbonylphenyl)piperazine (CAS 158985-36-5), with molecular formula C17H24N2O4 and molecular weight 320.17 g/mol. IUPAC: tert-butyl 4-(4-methoxycarbonylphenyl)piperazine-1-carboxylate.
Chemical Property Profile of 1-Boc-4-(4-methoxycarbonylphenyl)piperazine
Property Insights of 1-Boc-4-(4-methoxycarbonylphenyl)piperazine
The XLogP value of 2.5303 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Boc-4-(4-methoxycarbonylphenyl)piperazine. With a topological polar surface area (TPSA) of 59.08 Ų, 1-Boc-4-(4-methoxycarbonylphenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Boc-4-(4-methoxycarbonylphenyl)piperazine has 0 hydrogen bond donor(s) and 5 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 1-Boc-4-(4-methoxycarbonylphenyl)piperazine?
The CAS number of 1-Boc-4-(4-methoxycarbonylphenyl)piperazine is 158985-36-5.
What is the molecular formula of 1-Boc-4-(4-methoxycarbonylphenyl)piperazine?
The molecular formula of 1-Boc-4-(4-methoxycarbonylphenyl)piperazine is C17H24N2O4.
What is the molecular weight of 1-Boc-4-(4-methoxycarbonylphenyl)piperazine?
The molecular weight of 1-Boc-4-(4-methoxycarbonylphenyl)piperazine is 320.17 g/mol.
Where can I buy 1-Boc-4-(4-methoxycarbonylphenyl)piperazine?
You can request a quote for 1-Boc-4-(4-methoxycarbonylphenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Boc-4-(4-methoxycarbonylphenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Boc-4-(4-methoxycarbonylphenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.