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2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate
TL;DR: 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate (CAS 324779-70-6) is a chemical compound with molecular formula C13H12N2O3S and molecular weight 276.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridine-3-carbonylamino)ethyl thiophene-2-carboxylate
Also Known As: BAS 03379624, BIM-0037163.P001, 2-(nicotinamido)ethyl thiophene-2-carboxylate, 2-[(pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate, AF-399/13200014
| Molecular Formula | C13H12N2O3S |
|---|---|
| Molecular Weight | 276.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 276.05685 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 324779-70-6 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)NCCOC(=O)C2=CC=CS2 |
| InChIKey | RQAPYZZJBBMLHB-UHFFFAOYSA-N |
Product Overview
2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate (CAS 324779-70-6), with molecular formula C13H12N2O3S and molecular weight 276.06 g/mol. IUPAC: 2-(pyridine-3-carbonylamino)ethyl thiophene-2-carboxylate.
Chemical Property Profile of 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate
Property Insights of 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate. Following Lipinski's Rule of Five, 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-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 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate?
The CAS number of 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate is 324779-70-6.
What is the molecular formula of 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate?
The molecular formula of 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate is C13H12N2O3S.
What is the molecular weight of 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate?
The molecular weight of 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate is 276.06 g/mol.
Where can I buy 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate?
You can request a quote for 2-[(Pyridin-3-ylcarbonyl)amino]ethyl 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-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Pyridin-3-ylcarbonyl)amino]ethyl thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.