5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid
TL;DR: 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid (CAS 627470-18-2) is a chemical compound with molecular formula C10H8N4O3 and molecular weight 232.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(pyridin-4-ylcarbamoyl)-1H-imidazole-5-carboxylic acid
Also Known As: 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid, BAS 06265593, 4-(pyridin-4-ylcarbamoyl)-1H-imidazole-5-carboxylic acid, 4-(pyridin-4-ylcarbamoyl)-1H-imidazole-5-carboxylicacid, 5-(Pyridin-4-ylcarbamoyl)-1H-imidazole-4-carboxylic acid
| Molecular Formula | C10H8N4O3 |
|---|---|
| Molecular Weight | 232.06 g/mol |
| LogP | 0.7552 |
| Topological Polar Surface Area | 107.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.05965 |
| Heavy Atoms | 17 |
| Complexity | 549.6885 |
Chemical Identifiers
| CAS Number | 627470-18-2 |
|---|---|
| SMILES | C1=CN=CC=C1NC(=O)C2=C(NC=N2)C(=O)O |
Product Overview
5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid (CAS 627470-18-2), with molecular formula C10H8N4O3 and molecular weight 232.06 g/mol. IUPAC: 4-(pyridin-4-ylcarbamoyl)-1H-imidazole-5-carboxylic acid.
Chemical Property Profile of 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid
Property Insights of 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid
The XLogP value of 0.7552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid. The TPSA of 107.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid. Following Lipinski's Rule of Five, 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid has 3 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 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid?
The CAS number of 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid is 627470-18-2.
What is the molecular formula of 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid?
The molecular formula of 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid is C10H8N4O3.
What is the molecular weight of 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid?
The molecular weight of 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid is 232.06 g/mol.
Where can I buy 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid?
You can request a quote for 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(Pyridin-4-ylcarbamoyl)-3H-imidazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.