![Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate structure](/static/products/915/91524-77-5.png)
Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate
TL;DR: Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate (CAS 91524-77-5) is a chemical compound with molecular formula C13H18N2O4S and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate
Also Known As: ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate, Butanoic acid, 3-[[(4-methylphenyl)sulfonyl]hydrazono]-, ethyl ester, (Z)-, ethyl (3E)-3-[(4-methylphenyl)sulfonylhydrazinylidene]butano, ethyl 3-{2-[(4-methylphenyl)sulfonyl]hydrazinylidene}butanoate, Ethyl 3-[2-(4-methylbenzene-1-sulfonyl)hydrazinylidene]butanoate
| Molecular Formula | C13H18N2O4S |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 93.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 298.09872 |
| Heavy Atoms | 20 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 91524-77-5 |
|---|---|
| SMILES | CCOC(=O)CC(=NNS(=O)(=O)C1=CC=C(C=C1)C)C |
| InChIKey | OKOCJGPSMJXEBE-UHFFFAOYSA-N |
Product Overview
Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate (CAS 91524-77-5), with molecular formula C13H18N2O4S and molecular weight 298.10 g/mol. IUPAC: ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate.
Chemical Property Profile of Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate
Property Insights of Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate. Following Lipinski's Rule of Five, Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate has 1 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 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate?
The CAS number of Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate is 91524-77-5.
What is the molecular formula of Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate?
The molecular formula of Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate is C13H18N2O4S.
What is the molecular weight of Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate?
The molecular weight of Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate is 298.10 g/mol.
Where can I buy Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate?
You can request a quote for Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[(4-methylphenyl)sulfonylhydrazinylidene]butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.