![ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate structure](/static/products/4296/429654-66-0.webp)
ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate
TL;DR: ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate (CAS 429654-66-0) is a chemical compound with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[benzenesulfonyl(benzyl)amino]acetyl]amino]benzoate
Also Known As: ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate, ethyl 4-(2-(N-benzylphenylsulfonamido)acetamido)benzoate, ethyl 4-[[2-[benzenesulfonyl(benzyl)amino]acetyl]amino]benzoate, ETHYL 4-[2-(N-BENZYLBENZENESULFONAMIDO)ACETAMIDO]BENZOATE
| Molecular Formula | C24H24N2O5S |
|---|---|
| Molecular Weight | 452.14 g/mol |
| LogP | 3.6929 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 452.1406 |
| Heavy Atoms | 32 |
| Complexity | 1148.0135 |
Chemical Identifiers
| CAS Number | 429654-66-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3 |
Product Overview
ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate (CAS 429654-66-0), with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol. IUPAC: ethyl 4-[[2-[benzenesulfonyl(benzyl)amino]acetyl]amino]benzoate.
Chemical Property Profile of ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate
Property Insights of ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate
The XLogP value of 3.6929 indicates that ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate. Following Lipinski's Rule of Five, ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate 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-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
The CAS number of ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate is 429654-66-0.
What is the molecular formula of ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
The molecular formula of ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate is C24H24N2O5S.
What is the molecular weight of ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
The molecular weight of ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate is 452.14 g/mol.
Where can I buy ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
You can request a quote for ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]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-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-{[N-benzyl-N-(phenylsulfonyl)glycyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.