![ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate structure](/static/products/5148/514856-03-2.webp)
ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate
TL;DR: ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate (CAS 514856-03-2) is a chemical compound with molecular formula C22H18ClIN2O4S and molecular weight 567.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(4-chlorophenyl)carbamoyl]-2-[(2-iodobenzoyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate, ethyl 5-[(4-chlorophenyl)carbamoyl]-2-[(2-iodobenzoyl)amino]-4-methylthiophene-3-carboxylate, ethyl 5-((4-chlorophenyl)carbamoyl)-2-(2-iodobenzamido)-4-methylthiophene-3-carboxylate, ethyl 5-[(4-chlorophenyl)carbamoyl]-2-{[(2-iodophenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate
| Molecular Formula | C22H18ClIN2O4S |
|---|---|
| Molecular Weight | 567.97 g/mol |
| LogP | 5.99582 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 567.97205 |
| Heavy Atoms | 31 |
| Complexity | 1144.9127 |
Chemical Identifiers
| CAS Number | 514856-03-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3I |
Product Overview
ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate (CAS 514856-03-2), with molecular formula C22H18ClIN2O4S and molecular weight 567.97 g/mol. IUPAC: ethyl 5-[(4-chlorophenyl)carbamoyl]-2-[(2-iodobenzoyl)amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate
Property Insights of ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate
The XLogP value of 5.99582 indicates that ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate. Following Lipinski's Rule of Five, ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
The CAS number of ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate is 514856-03-2.
What is the molecular formula of ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
The molecular formula of ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate is C22H18ClIN2O4S.
What is the molecular weight of ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
The molecular weight of ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate is 567.97 g/mol.
Where can I buy ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
You can request a quote for ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-[(4-chloroanilino)carbonyl]-2-[(2-iodobenzoyl)amino]-4-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.