![Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate structure](/static/products/866/866152-78-5.png)
Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate
TL;DR: Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate (CAS 866152-78-5) is a chemical compound with molecular formula C13H17NO4S and molecular weight 283.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(4-methylphenyl)sulfonylazetidine-3-carboxylate
Also Known As: ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate, ethyl 1-(4-methylbenzenesulfonyl)azetidine-3-carboxylate, ethyl 1-(4-methylphenyl)sulfonylazetidine-3-carboxylate, ethyl 1-(p-tolylsulfonyl)azetidine-3-carboxylate, ethyl1-(4-methylbenzenesulfonyl)azetidine-3-carboxylate
| Molecular Formula | C13H17NO4S |
|---|---|
| Molecular Weight | 283.09 g/mol |
| LogP | 1.17862 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.08783 |
| Heavy Atoms | 19 |
| Complexity | 558.8109 |
Chemical Identifiers
| CAS Number | 866152-78-5 |
|---|---|
| SMILES | CCOC(=O)C1CN(C1)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate (CAS 866152-78-5), with molecular formula C13H17NO4S and molecular weight 283.09 g/mol. IUPAC: ethyl 1-(4-methylphenyl)sulfonylazetidine-3-carboxylate.
Chemical Property Profile of Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate
Property Insights of Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate
The XLogP value of 1.17862 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate. Following Lipinski's Rule of Five, Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate has 0 hydrogen bond donor(s) and 4 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 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate?
The CAS number of Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate is 866152-78-5.
What is the molecular formula of Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate?
The molecular formula of Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate is C13H17NO4S.
What is the molecular weight of Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate?
The molecular weight of Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate is 283.09 g/mol.
Where can I buy Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate?
You can request a quote for Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-[(4-methylphenyl)sulfonyl]-3-azetanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.