![[2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate structure](/static/products/3912/391263-70-0.webp)
[2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate
TL;DR: [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate (CAS 391263-70-0) is a chemical compound with molecular formula C13H10ClNO3S and molecular weight 295.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-chloroanilino)-2-oxoethyl] thiophene-2-carboxylate
Also Known As: BAS 05139667, SDCCGSBI-0661321.P001, [2-(2-chloroanilino)-2-oxoethyl] thiophene-2-carboxylate, 2-(2-Chloroanilino)-2-oxoethyl thiophene-2-carboxylate, [N-(2-chlorophenyl)carbamoyl]methyl thiophene-2-carboxylate
| Molecular Formula | C13H10ClNO3S |
|---|---|
| Molecular Weight | 295.01 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.007 |
| Heavy Atoms | 19 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 391263-70-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=O)COC(=O)C2=CC=CS2)Cl |
| InChIKey | XSQUDSZIUWVKHG-UHFFFAOYSA-N |
Product Overview
[2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate (CAS 391263-70-0), with molecular formula C13H10ClNO3S and molecular weight 295.01 g/mol. IUPAC: [2-(2-chloroanilino)-2-oxoethyl] thiophene-2-carboxylate.
Chemical Property Profile of [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate
Property Insights of [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate
The XLogP value of 3.3 indicates that [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate. Following Lipinski's Rule of Five, [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate has 1 hydrogen bond donor(s) and 4 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 [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate?
The CAS number of [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate is 391263-70-0.
What is the molecular formula of [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate?
The molecular formula of [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate is C13H10ClNO3S.
What is the molecular weight of [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate?
The molecular weight of [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate is 295.01 g/mol.
Where can I buy [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate?
You can request a quote for [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(2-Chloroanilino)-2-oxoethyl] thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.