ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate
TL;DR: ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate (CAS 312758-82-0) is a chemical compound with molecular formula C12H12N4O3 and molecular weight 260.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate
Also Known As: ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate, 4-(2-Pyridylaminocarbonyl)-5-ethoxycarbonyl-imidazole, 4-(2-pyridylcarbamoyl)-1H-imidazole-5-carboxylic acid ethyl ester, Ethyl 4-[(2-pyridinylamino)carbonyl]-1H-imidazole-5-carboxylate #, 4-[oxo-(2-pyridinylamino)methyl]-1H-imidazole-5-carboxylic acid ethyl ester
| Molecular Formula | C12H12N4O3 |
|---|---|
| Molecular Weight | 260.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 97.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.09094 |
| Heavy Atoms | 19 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 312758-82-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=CN1)C(=O)NC2=CC=CC=N2 |
| InChIKey | NLPHFAQEHGHOLE-UHFFFAOYSA-N |
Product Overview
ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate (CAS 312758-82-0), with molecular formula C12H12N4O3 and molecular weight 260.09 g/mol. IUPAC: ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate.
Chemical Property Profile of ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate
Property Insights of ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate. The TPSA of 97.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate has 2 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 ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate?
The CAS number of ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate is 312758-82-0.
What is the molecular formula of ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate?
The molecular formula of ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate is C12H12N4O3.
What is the molecular weight of ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate?
The molecular weight of ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate is 260.09 g/mol.
Where can I buy ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate?
You can request a quote for ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(pyridin-2-ylcarbamoyl)-1H-imidazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.