ethyl l)piperazine
TL;DR: ethyl l)piperazine (CAS 312585-07-2) is a chemical compound with molecular formula C17H18BrNO4S and molecular weight 411.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5-bromofuran-2-carbonyl)amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: ethyl l)piperazine, BAS 01077641, ethyl 2-[(5-bromofuran-2-carbonyl)amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ETHYL 2-(5-BROMOFURAN-2-AMIDO)-5-METHYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, ethyl 2-(5-bromofuran-2-carboxamido)-5-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C17H18BrNO4S |
|---|---|
| Molecular Weight | 411.01 g/mol |
| LogP | 4.6574 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.01398 |
| Heavy Atoms | 24 |
| Complexity | 779.6477 |
Chemical Identifiers
| CAS Number | 312585-07-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CC(CC2)C)NC(=O)C3=CC=C(O3)Br |
Product Overview
ethyl l)piperazine (CAS 312585-07-2), with molecular formula C17H18BrNO4S and molecular weight 411.01 g/mol. IUPAC: ethyl 2-[(5-bromofuran-2-carbonyl)amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of ethyl l)piperazine
Property Insights of ethyl l)piperazine
The XLogP value of 4.6574 indicates that ethyl l)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl l)piperazine. Following Lipinski's Rule of Five, ethyl l)piperazine has 1 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 ethyl l)piperazine?
The CAS number of ethyl l)piperazine is 312585-07-2.
What is the molecular formula of ethyl l)piperazine?
The molecular formula of ethyl l)piperazine is C17H18BrNO4S.
What is the molecular weight of ethyl l)piperazine?
The molecular weight of ethyl l)piperazine is 411.01 g/mol.
Where can I buy ethyl l)piperazine?
You can request a quote for ethyl l)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl l)piperazine?
Yes, KEHONG BIO provides custom synthesis services for ethyl l)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.