![Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate structure](/static/products/4788/4788-68-5.webp)
Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate
TL;DR: Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate (CAS 4788-68-5) is a chemical compound with molecular formula C16H23N5O4 and molecular weight 349.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate
Also Known As: ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate, ethyl 4-[acetyl-[(3Z)-4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate
| Molecular Formula | C16H23N5O4 |
|---|---|
| Molecular Weight | 349.18 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 349.17502 |
| Heavy Atoms | 25 |
| Complexity | 501.0 |
Chemical Identifiers
| CAS Number | 4788-68-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N(CCC(=NNC(=O)N)CN)C(=O)C |
| InChIKey | JTOANUXRSBIVKQ-UHFFFAOYSA-N |
Product Overview
Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate (CAS 4788-68-5), with molecular formula C16H23N5O4 and molecular weight 349.18 g/mol. IUPAC: ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate
Property Insights of Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate
The XLogP value of -0.5 indicates that Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate has 3 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-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate?
The CAS number of Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate is 4788-68-5.
What is the molecular formula of Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate?
The molecular formula of Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate is C16H23N5O4.
What is the molecular weight of Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate?
The molecular weight of Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate is 349.18 g/mol.
Where can I buy Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate?
You can request a quote for Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[acetyl-[4-amino-3-(carbamoylhydrazinylidene)butyl]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.