![{[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate structure](/static/products/5651/565172-75-0.webp)
{[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate
TL;DR: {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate (CAS 565172-75-0) is a chemical compound with molecular formula C13H11ClN2O3S and molecular weight 310.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-chloropyridine-3-carboxylate
Also Known As: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-chloropyridine-3-carboxylate, {[(thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate
| Molecular Formula | C13H11ClN2O3S |
|---|---|
| Molecular Weight | 310.02 g/mol |
| LogP | 2.2697 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.01788 |
| Heavy Atoms | 20 |
| Complexity | 601.4236 |
Chemical Identifiers
| CAS Number | 565172-75-0 |
|---|---|
| SMILES | C1=CC(=C(N=C1)Cl)C(=O)OCC(=O)NCC2=CC=CS2 |
Product Overview
{[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate (CAS 565172-75-0), with molecular formula C13H11ClN2O3S and molecular weight 310.02 g/mol. IUPAC: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-chloropyridine-3-carboxylate.
Chemical Property Profile of {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate
Property Insights of {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate
The XLogP value of 2.2697 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate has 1 hydrogen bond donor(s) and 5 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 {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
The CAS number of {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate is 565172-75-0.
What is the molecular formula of {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
The molecular formula of {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate is C13H11ClN2O3S.
What is the molecular weight of {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
The molecular weight of {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate is 310.02 g/mol.
Where can I buy {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
You can request a quote for {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for {[(Thiophen-2-yl)methyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.