ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate
TL;DR: ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate (CAS 690685-09-7) is a chemical compound with molecular formula C21H23Cl2N3O5S and molecular weight 499.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(3-chloro-N-(4-chlorophenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate
Also Known As: ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate, ethyl 4-(2-(4-chloro-N-(3-chlorophenyl)phenylsulfonamido)acetyl)piperazine-1-carboxylate, ethyl 4-[2-(3-chloro-N-(4-chlorophenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate, Ethyl 4-[2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]acetyl]piperazine-1-carboxylate
| Molecular Formula | C21H23Cl2N3O5S |
|---|---|
| Molecular Weight | 499.07 g/mol |
| LogP | 3.4894 |
| Topological Polar Surface Area | 87.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 499.07355 |
| Heavy Atoms | 32 |
| Complexity | 1071.0977 |
Chemical Identifiers
| CAS Number | 690685-09-7 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate (CAS 690685-09-7), with molecular formula C21H23Cl2N3O5S and molecular weight 499.07 g/mol. IUPAC: ethyl 4-[2-(3-chloro-N-(4-chlorophenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate
Property Insights of ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate
The XLogP value of 3.4894 indicates that ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.23 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate. Following Lipinski's Rule of Five, ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate 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-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
The CAS number of ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate is 690685-09-7.
What is the molecular formula of ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
The molecular formula of ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate is C21H23Cl2N3O5S.
What is the molecular weight of ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
The molecular weight of ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate is 499.07 g/mol.
Where can I buy ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
You can request a quote for ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}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-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-{N-(3-chlorophenyl)-N-[(4-chlorophenyl)sulfonyl]glycyl}piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.