Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester
TL;DR: Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester (CAS 681852-61-9) is a chemical compound with molecular formula C16H24N2O5S and molecular weight 356.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-methoxy-2,5-dimethylphenyl)sulfonylpiperazine-1-carboxylate
Also Known As: Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester, AP-263/43505365, ethyl 4-(4-methoxy-2,5-dimethylphenyl)sulfonylpiperazine-1-carboxylate, A2939/0123759, ethyl 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)piperazine-1-carboxylate
| Molecular Formula | C16H24N2O5S |
|---|---|
| Molecular Weight | 356.14 g/mol |
| LogP | 1.77484 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.1406 |
| Heavy Atoms | 24 |
| Complexity | 709.4231 |
Chemical Identifiers
| CAS Number | 681852-61-9 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2C)OC)C |
Product Overview
Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester (CAS 681852-61-9), with molecular formula C16H24N2O5S and molecular weight 356.14 g/mol. IUPAC: ethyl 4-(4-methoxy-2,5-dimethylphenyl)sulfonylpiperazine-1-carboxylate.
Chemical Property Profile of Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester
Property Insights of Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester
The XLogP value of 1.77484 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester. Following Lipinski's Rule of Five, Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester 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 Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester?
The CAS number of Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester is 681852-61-9.
What is the molecular formula of Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester?
The molecular formula of Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester is C16H24N2O5S.
What is the molecular weight of Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester?
The molecular weight of Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester is 356.14 g/mol.
Where can I buy Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester?
You can request a quote for Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Piperazine-1-carboxylic acid, 4-(4-methoxy-2,5-dimethylbenzenesulfonyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.