![(E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate structure](/static/products/301/301682-20-2.png)
(E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
TL;DR: (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate (CAS 301682-20-2) is a chemical compound with molecular formula C19H19N3O6S and molecular weight 417.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyl-2-[[(E)-1,3-benzodioxol-5-ylmethylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate
Also Known As: (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate, ETHYL 5-ACETYL-2-({[(2E)-2-(1,3-BENZODIOXOL-5-YLMETHYLENE)HYDRAZINO]CARBONYL}AMINO)-4-METHYL-3-THIOPHENECARBOXYLATE, ethyl 5-acetyl-2-[[(E)-1,3-benzodioxol-5-ylmethylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate
| Molecular Formula | C19H19N3O6S |
|---|---|
| Molecular Weight | 417.10 g/mol |
| LogP | 3.32012 |
| Topological Polar Surface Area | 115.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.09946 |
| Heavy Atoms | 29 |
| Complexity | 998.071 |
Chemical Identifiers
| CAS Number | 301682-20-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)N/N=C/C2=CC3=C(C=C2)OCO3 |
Product Overview
(E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate (CAS 301682-20-2), with molecular formula C19H19N3O6S and molecular weight 417.10 g/mol. IUPAC: ethyl 5-acetyl-2-[[(E)-1,3-benzodioxol-5-ylmethylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
Property Insights of (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
The XLogP value of 3.32012 indicates that (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.32 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate has 2 hydrogen bond donor(s) and 8 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-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The CAS number of (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is 301682-20-2.
What is the molecular formula of (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The molecular formula of (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is C19H19N3O6S.
What is the molecular weight of (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The molecular weight of (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is 417.10 g/mol.
Where can I buy (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
You can request a quote for (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)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-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 5-acetyl-2-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.