Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate
TL;DR: Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate (CAS 873586-95-9) is a chemical compound with molecular formula C18H28N2O5S and molecular weight 384.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylpiperazine-1-carboxylate
Also Known As: ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate, AP-263/43302542, ethyl 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylpiperazine-1-carboxylate, ethyl 4-{[4-methoxy-2-methyl-5-(methylethyl)phenyl]sulfonyl}piperazinecarboxyl ate
| Molecular Formula | C18H28N2O5S |
|---|---|
| Molecular Weight | 384.17 g/mol |
| LogP | 2.58982 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.1719 |
| Heavy Atoms | 26 |
| Complexity | 753.0901 |
Chemical Identifiers
| CAS Number | 873586-95-9 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2C)OC)C(C)C |
Product Overview
Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate (CAS 873586-95-9), with molecular formula C18H28N2O5S and molecular weight 384.17 g/mol. IUPAC: ethyl 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylpiperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate
Property Insights of Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate
The XLogP value of 2.58982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate. Following Lipinski's Rule of Five, Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate 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 Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate?
The CAS number of Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate is 873586-95-9.
What is the molecular formula of Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate?
The molecular formula of Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate is C18H28N2O5S.
What is the molecular weight of Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate?
The molecular weight of Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate is 384.17 g/mol.
Where can I buy Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate?
You can request a quote for Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(5-isopropyl-4-methoxy-2-methylphenyl)sulfonyl]-1-piperazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.