![Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate structure](/static/products/4735/473566-57-3.webp)
Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate
TL;DR: Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate (CAS 473566-57-3) is a chemical compound with molecular formula C26H27N3O7S2 and molecular weight 557.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[1,4-bis(benzenesulfonyl)piperazine-2-carbonyl]amino]benzoate
Also Known As: BIM-0004702.P001, ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate, AH-487/14754083, ethyl 4-[[1,4-bis(benzenesulfonyl)piperazine-2-carbonyl]amino]benzoate
| Molecular Formula | C26H27N3O7S2 |
|---|---|
| Molecular Weight | 557.13 g/mol |
| LogP | 2.5658 |
| Topological Polar Surface Area | 130.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 557.129 |
| Heavy Atoms | 38 |
| Complexity | 1495.4061 |
Chemical Identifiers
| CAS Number | 473566-57-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CN(CCN2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4 |
Product Overview
Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate (CAS 473566-57-3), with molecular formula C26H27N3O7S2 and molecular weight 557.13 g/mol. IUPAC: ethyl 4-[[1,4-bis(benzenesulfonyl)piperazine-2-carbonyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate
Property Insights of Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate
The XLogP value of 2.5658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate. The TPSA of 130.16 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate. Following Lipinski's Rule of Five, Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate?
The CAS number of Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate is 473566-57-3.
What is the molecular formula of Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate?
The molecular formula of Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate is C26H27N3O7S2.
What is the molecular weight of Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate?
The molecular weight of Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate is 557.13 g/mol.
Where can I buy Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate?
You can request a quote for Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-({[1,4-bis(phenylsulfonyl)-2-piperazinyl]carbonyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.