(E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
TL;DR: (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate (CAS 301682-18-8) is a chemical compound with molecular formula C18H18ClN3O4S and molecular weight 407.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyl-2-[[(E)-(4-chlorophenyl)methylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate
Also Known As: (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate, ETHYL 5-ACETYL-2-({[(2E)-2-(4-CHLOROBENZYLIDENE)HYDRAZINO]CARBONYL}AMINO)-4-METHYL-3-THIOPHENECARBOXYLATE, ethyl 5-acetyl-2-({[(2E)-2-(4-chlorobenzylidene)hydrazinyl]carbonyl}amino)-4-methylthiophene-3-carboxylate, ethyl 5-acetyl-2-[[(E)-(4-chlorophenyl)methylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate
| Molecular Formula | C18H18ClN3O4S |
|---|---|
| Molecular Weight | 407.07 g/mol |
| LogP | 4.24482 |
| Topological Polar Surface Area | 96.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.07065 |
| Heavy Atoms | 27 |
| Complexity | 890.75684 |
Chemical Identifiers
| CAS Number | 301682-18-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)N/N=C/C2=CC=C(C=C2)Cl |
Product Overview
(E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate (CAS 301682-18-8), with molecular formula C18H18ClN3O4S and molecular weight 407.07 g/mol. IUPAC: ethyl 5-acetyl-2-[[(E)-(4-chlorophenyl)methylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
Property Insights of (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
The XLogP value of 4.24482 indicates that (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate has 2 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 (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The CAS number of (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is 301682-18-8.
What is the molecular formula of (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The molecular formula of (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is C18H18ClN3O4S.
What is the molecular weight of (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The molecular weight of (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is 407.07 g/mol.
Where can I buy (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
You can request a quote for (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 5-acetyl-2-(2-(4-chlorobenzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.