![methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate structure](/static/products/4296/429625-16-1.webp)
methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate
TL;DR: methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate (CAS 429625-16-1) is a chemical compound with molecular formula C22H26N2O5S and molecular weight 430.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-[benzenesulfonyl(cyclohexyl)amino]acetyl]amino]benzoate
Also Known As: AN-989/40683965, methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate, methyl 2-(2-(N-cyclohexylphenylsulfonamido)acetamido)benzoate, methyl 2-({[cyclohexyl(phenylsulfonyl)amino]acetyl}amino)benzoate, Methyl 2-[[2-(benzenesulfonyl-cyclohexyl-amino)acetyl]amino]benzoate
| Molecular Formula | C22H26N2O5S |
|---|---|
| Molecular Weight | 430.16 g/mol |
| LogP | 3.4353 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.15625 |
| Heavy Atoms | 30 |
| Complexity | 985.5973 |
Chemical Identifiers
| CAS Number | 429625-16-1 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)CN(C2CCCCC2)S(=O)(=O)C3=CC=CC=C3 |
Product Overview
methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate (CAS 429625-16-1), with molecular formula C22H26N2O5S and molecular weight 430.16 g/mol. IUPAC: methyl 2-[[2-[benzenesulfonyl(cyclohexyl)amino]acetyl]amino]benzoate.
Chemical Property Profile of methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate
Property Insights of methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate
The XLogP value of 3.4353 indicates that methyl 2-{[N-cyclohexyl-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 methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate. Following Lipinski's Rule of Five, methyl 2-{[N-cyclohexyl-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 methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
The CAS number of methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate is 429625-16-1.
What is the molecular formula of methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
The molecular formula of methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate is C22H26N2O5S.
What is the molecular weight of methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
The molecular weight of methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate is 430.16 g/mol.
Where can I buy methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
You can request a quote for methyl 2-{[N-cyclohexyl-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 methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-{[N-cyclohexyl-N-(phenylsulfonyl)glycyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.