![ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate structure](/static/products/349/349630-96-2.png)
ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate
TL;DR: ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate (CAS 349630-96-2) is a chemical compound with molecular formula C16H21N3O4 and molecular weight 319.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (3E)-3-[(4-anilino-4-oxobutanoyl)hydrazinylidene]butanoate
Also Known As: ethyl 3-[(4-anilino-4-oxobutanoyl)hydrazono]butanoate, ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate
| Molecular Formula | C16H21N3O4 |
|---|---|
| Molecular Weight | 319.15 g/mol |
| LogP | 1.8506 |
| Topological Polar Surface Area | 96.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 319.1532 |
| Heavy Atoms | 23 |
| Complexity | 569.9479 |
Chemical Identifiers
| CAS Number | 349630-96-2 |
|---|---|
| SMILES | CCOC(=O)C/C(=N/NC(=O)CCC(=O)NC1=CC=CC=C1)/C |
Product Overview
ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate (CAS 349630-96-2), with molecular formula C16H21N3O4 and molecular weight 319.15 g/mol. IUPAC: ethyl (3E)-3-[(4-anilino-4-oxobutanoyl)hydrazinylidene]butanoate.
Chemical Property Profile of ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate
Property Insights of ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate
The XLogP value of 1.8506 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate. The TPSA of 96.86 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate. Following Lipinski's Rule of Five, ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate has 2 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 ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate?
The CAS number of ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate is 349630-96-2.
What is the molecular formula of ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate?
The molecular formula of ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate is C16H21N3O4.
What is the molecular weight of ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate?
The molecular weight of ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate is 319.15 g/mol.
Where can I buy ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate?
You can request a quote for ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (3E)-3-{2-[4-oxo-4-(phenylamino)butanoyl]hydrazinylidene}butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.