Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate
TL;DR: Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate (CAS 433707-63-2) is a chemical compound with molecular formula C22H26N2O7S and molecular weight 462.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate
Also Known As: Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate, methyl 2-(1-((3,4-dimethoxyphenyl)sulfonyl)piperidine-4-carboxamido)benzoate, methyl 2-[({1-[(3,4-dimethoxyphenyl)sulfonyl]piperidin-4-yl}carbonyl)amino]benzoate, METHYL 2-[1-(3,4-DIMETHOXYBENZENESULFONYL)PIPERIDINE-4-AMIDO]BENZOATE
| Molecular Formula | C22H26N2O7S |
|---|---|
| Molecular Weight | 462.15 g/mol |
| LogP | 2.5298 |
| Topological Polar Surface Area | 111.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.14606 |
| Heavy Atoms | 32 |
| Complexity | 1093.2083 |
Chemical Identifiers
| CAS Number | 433707-63-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)OC)OC |
Product Overview
Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate (CAS 433707-63-2), with molecular formula C22H26N2O7S and molecular weight 462.15 g/mol. IUPAC: methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate.
Chemical Property Profile of Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate
Property Insights of Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate
The XLogP value of 2.5298 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate. The TPSA of 111.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate. Following Lipinski's Rule of Five, Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate has 1 hydrogen bond donor(s) and 7 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-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate?
The CAS number of Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate is 433707-63-2.
What is the molecular formula of Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate?
The molecular formula of Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate is C22H26N2O7S.
What is the molecular weight of Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate?
The molecular weight of Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate is 462.15 g/mol.
Where can I buy Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate?
You can request a quote for Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-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-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[[1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.