![ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate structure](/static/products/836/836665-01-1.png)
ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate
TL;DR: ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate (CAS 836665-01-1) is a chemical compound with molecular formula C21H31N3O6S and molecular weight 453.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate
Also Known As: ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate, ethyl 4-({1-[(2-methoxy-5-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)-1-piperazinecarboxylate, ethyl 4-({1-[(2-methoxy-5-methylphenyl)sulfonyl]piperidin-4-yl}carbonyl)piperazine-1-carboxylate, 4-[[1-(2-methoxy-5-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester, 4-[1-(2-methoxy-5-methyl-phenyl)sulfonylisonipecotoyl]piperazine-1-carboxylic acid ethyl ester
| Molecular Formula | C21H31N3O6S |
|---|---|
| Molecular Weight | 453.19 g/mol |
| LogP | 1.70502 |
| Topological Polar Surface Area | 96.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.19336 |
| Heavy Atoms | 31 |
| Complexity | 903.6902 |
Chemical Identifiers
| CAS Number | 836665-01-1 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)OC |
Product Overview
ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate (CAS 836665-01-1), with molecular formula C21H31N3O6S and molecular weight 453.19 g/mol. IUPAC: ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate
Property Insights of ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate
The XLogP value of 1.70502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate. The TPSA of 96.46 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate. Following Lipinski's Rule of Five, ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate has 0 hydrogen bond donor(s) and 6 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-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate?
The CAS number of ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate is 836665-01-1.
What is the molecular formula of ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate?
The molecular formula of ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate is C21H31N3O6S.
What is the molecular weight of ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate?
The molecular weight of ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate is 453.19 g/mol.
Where can I buy ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate?
You can request a quote for ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate 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-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-[1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.