Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate
TL;DR: Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate (CAS 899758-59-9) is a chemical compound with molecular formula C16H23N3O5S and molecular weight 369.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-benzamidoethylsulfonyl)piperazine-1-carboxylate
Also Known As: VU0495909-1, ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate, ethyl 4-(2-benzamidoethylsulfonyl)piperazine-1-carboxylate, ethyl 4-[2-(phenylformamido)ethanesulfonyl]piperazine-1-carboxylate
| Molecular Formula | C16H23N3O5S |
|---|---|
| Molecular Weight | 369.14 g/mol |
| LogP | 0.5203 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.13583 |
| Heavy Atoms | 25 |
| Complexity | 684.98157 |
Chemical Identifiers
| CAS Number | 899758-59-9 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)S(=O)(=O)CCNC(=O)C2=CC=CC=C2 |
Product Overview
Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate (CAS 899758-59-9), with molecular formula C16H23N3O5S and molecular weight 369.14 g/mol. IUPAC: ethyl 4-(2-benzamidoethylsulfonyl)piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate
Property Insights of Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate
The XLogP value of 0.5203 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate 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 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate?
The CAS number of Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate is 899758-59-9.
What is the molecular formula of Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate?
The molecular formula of Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate is C16H23N3O5S.
What is the molecular weight of Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate?
The molecular weight of Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate is 369.14 g/mol.
Where can I buy Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate?
You can request a quote for Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-((2-benzamidoethyl)sulfonyl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.