![Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate structure](/static/products/7682/768293-40-9.webp)
Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate
TL;DR: Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate (CAS 768293-40-9) is a chemical compound with molecular formula C20H21BrN2O5S and molecular weight 480.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[1-(4-bromophenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate
Also Known As: methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate, methyl 2-(1-((4-bromophenyl)sulfonyl)piperidine-4-carboxamido)benzoate, methyl 2-[[1-(4-bromophenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate
| Molecular Formula | C20H21BrN2O5S |
|---|---|
| Molecular Weight | 480.04 g/mol |
| LogP | 3.2751 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.03546 |
| Heavy Atoms | 29 |
| Complexity | 999.78656 |
Chemical Identifiers
| CAS Number | 768293-40-9 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br |
Product Overview
Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate (CAS 768293-40-9), with molecular formula C20H21BrN2O5S and molecular weight 480.04 g/mol. IUPAC: methyl 2-[[1-(4-bromophenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate.
Chemical Property Profile of Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate
Property Insights of Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate
The XLogP value of 3.2751 indicates that Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)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-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate. Following Lipinski's Rule of Five, Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)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-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate?
The CAS number of Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate is 768293-40-9.
What is the molecular formula of Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate?
The molecular formula of Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate is C20H21BrN2O5S.
What is the molecular weight of Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate?
The molecular weight of Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate is 480.04 g/mol.
Where can I buy Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate?
You can request a quote for Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}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 Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[({1-[(4-bromophenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.