![1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine structure](/static/products/4729/472985-12-9.webp)
1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine
TL;DR: 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine (CAS 472985-12-9) is a chemical compound with molecular formula C16H28N2 and molecular weight 248.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bicyclo[2.2.1]hept-5-enylmethyl)-4-butan-2-ylpiperazine
Also Known As: BAS 03050843, BRD-A53254071-001-01-8, 1-(5-bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine, 1-(bicyclo[2.2.1]hept-5-en-2-ylmethyl)-4-(butan-2-yl)piperazine, 1-Bicyclo[2.2.1]hept-5-en-2-ylmethyl-4-sec-butyl-piperazine
| Molecular Formula | C16H28N2 |
|---|---|
| Molecular Weight | 248.23 g/mol |
| LogP | 2.6147 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.22525 |
| Heavy Atoms | 18 |
| Complexity | 304.2188 |
Chemical Identifiers
| CAS Number | 472985-12-9 |
|---|---|
| SMILES | CCC(C)N1CCN(CC1)CC2CC3CC2C=C3 |
Product Overview
1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine (CAS 472985-12-9), with molecular formula C16H28N2 and molecular weight 248.23 g/mol. IUPAC: 1-(2-bicyclo[2.2.1]hept-5-enylmethyl)-4-butan-2-ylpiperazine.
Chemical Property Profile of 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine
Property Insights of 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine
The XLogP value of 2.6147 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine. With a topological polar surface area (TPSA) of 6.48 Ų, 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine has 0 hydrogen bond donor(s) and 2 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-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine?
The CAS number of 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine is 472985-12-9.
What is the molecular formula of 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine?
The molecular formula of 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine is C16H28N2.
What is the molecular weight of 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine?
The molecular weight of 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine is 248.23 g/mol.
Where can I buy 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine?
You can request a quote for 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Bicyclo[2.2.1]hept-2-enylmethyl)-4-butan-2-ylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.