Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate
TL;DR: Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate (CAS 488137-21-9) is a chemical compound with molecular formula C22H18ClN3O2S and molecular weight 423.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate
Also Known As: Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate, ethyl 2-((3-chloroquinoxalin-2-yl)amino)-4-(p-tolyl)thiophene-3-carboxylate
| Molecular Formula | C22H18ClN3O2S |
|---|---|
| Molecular Weight | 423.08 g/mol |
| LogP | 6.24042 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.0808 |
| Heavy Atoms | 29 |
| Complexity | 1188.6145 |
Chemical Identifiers
| CAS Number | 488137-21-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC3=NC4=CC=CC=C4N=C3Cl |
Product Overview
Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate (CAS 488137-21-9), with molecular formula C22H18ClN3O2S and molecular weight 423.08 g/mol. IUPAC: ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate.
Chemical Property Profile of Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate
Property Insights of Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate
The XLogP value of 6.24042 indicates that Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate?
The CAS number of Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate is 488137-21-9.
What is the molecular formula of Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate?
The molecular formula of Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate is C22H18ClN3O2S.
What is the molecular weight of Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate?
The molecular weight of Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate is 423.08 g/mol.
Where can I buy Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate?
You can request a quote for Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(3-chloroquinoxalin-2-yl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.