ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate
TL;DR: ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate (CAS 308293-87-0) is a chemical compound with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-methyl-2-[(E)-C-methyl-N-(3-phenylpropanoylamino)carbonimidoyl]butanoate
Also Known As: ethyl 2-isopropyl-3-[(3-phenylpropanoyl)hydrazono]butanoate, ethyl (3E)-3-methyl-2-(methylethyl)-4-(3-phenylpropanoylamino)-4-azabut-3-enoa te, ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate
| Molecular Formula | C18H26N2O3 |
|---|---|
| Molecular Weight | 318.19 g/mol |
| LogP | 2.9466 |
| Topological Polar Surface Area | 67.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 318.19434 |
| Heavy Atoms | 23 |
| Complexity | 538.4575 |
Chemical Identifiers
| CAS Number | 308293-87-0 |
|---|---|
| SMILES | CCOC(=O)C(C(C)C)/C(=N/NC(=O)CCC1=CC=CC=C1)/C |
Product Overview
ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate (CAS 308293-87-0), with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol. IUPAC: ethyl 3-methyl-2-[(E)-C-methyl-N-(3-phenylpropanoylamino)carbonimidoyl]butanoate.
Chemical Property Profile of ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate
Property Insights of ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate
The XLogP value of 2.9466 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate. The TPSA of 67.76 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate. Following Lipinski's Rule of Five, ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate has 1 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 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate?
The CAS number of ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate is 308293-87-0.
What is the molecular formula of ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate?
The molecular formula of ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate is C18H26N2O3.
What is the molecular weight of ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate?
The molecular weight of ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate is 318.19 g/mol.
Where can I buy ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate?
You can request a quote for ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}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-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-methyl-2-{(1E)-1-[2-(3-phenylpropanoyl)hydrazinylidene]ethyl}butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.