(E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
TL;DR: (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate (CAS 301682-16-6) is a chemical compound with molecular formula C22H28N4O4S and molecular weight 444.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyl-2-[[(E)-[4-(diethylamino)phenyl]methylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate
Also Known As: (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate, ethyl 2-[({(1E)-2-[4-(diethylamino)phenyl]-1-azavinyl}amino)carbonylamino]-5-a cetyl-4-methylthiophene-3-carboxylate, ETHYL 5-ACETYL-2-({N'-[(E)-[4-(DIETHYLAMINO)PHENYL]METHYLIDENE]HYDRAZINECARBONYL}AMINO)-4-METHYLTHIOPHENE-3-CARBOXYLATE, ETHYL 5-ACETYL-2-[({(2E)-2-[4-(DIETHYLAMINO)BENZYLIDENE]HYDRAZINO}CARBONYL)AMINO]-4-METHYL-3-THIOPHENECARBOXYLATE, ethyl 5-acetyl-2-[({(2E)-2-[4-(diethylamino)benzylidene]hydrazinyl}carbonyl)amino]-4-methylthiophene-3-carboxylate
| Molecular Formula | C22H28N4O4S |
|---|---|
| Molecular Weight | 444.18 g/mol |
| LogP | 4.43762 |
| Topological Polar Surface Area | 100.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 444.18314 |
| Heavy Atoms | 31 |
| Complexity | 962.6357 |
Chemical Identifiers
| CAS Number | 301682-16-6 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC |
Product Overview
(E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate (CAS 301682-16-6), with molecular formula C22H28N4O4S and molecular weight 444.18 g/mol. IUPAC: ethyl 5-acetyl-2-[[(E)-[4-(diethylamino)phenyl]methylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
Property Insights of (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate
The XLogP value of 4.43762 indicates that (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate has 2 hydrogen bond donor(s) and 7 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-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The CAS number of (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is 301682-16-6.
What is the molecular formula of (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The molecular formula of (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is C22H28N4O4S.
What is the molecular weight of (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
The molecular weight of (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate is 444.18 g/mol.
Where can I buy (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
You can request a quote for (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)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-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 5-acetyl-2-(2-(4-(diethylamino)benzylidene)hydrazinecarboxamido)-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.