Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester
TL;DR: Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester (CAS 78682-38-9) is a chemical compound with molecular formula C9H11N3O3 and molecular weight 209.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-carbamoyl-1H-imidazol-4-yl) cyclobutanecarboxylate
Also Known As: 5-(Aminocarbonyl)-1H-imidazol-4-yl cyclobutanecarboxylate, Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester, 5-Carbamoyl-1H-imidazole-4-yl cyclobutane-1'-carboxylate, (5-carbamoyl-1H-imidazol-4-yl) cyclobutanecarboxylate, 5-CARBAMOYL-1H-IMIDAZOL-4-YL CYCLOBUTANECARBOXYLATE
| Molecular Formula | C9H11N3O3 |
|---|---|
| Molecular Weight | 209.08 g/mol |
| LogP | 0.2141 |
| Topological Polar Surface Area | 98.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.08005 |
| Heavy Atoms | 15 |
| Complexity | 395.06177 |
Chemical Identifiers
| CAS Number | 78682-38-9 |
|---|---|
| SMILES | C1CC(C1)C(=O)OC2=C(NC=N2)C(=O)N |
Product Overview
Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester (CAS 78682-38-9), with molecular formula C9H11N3O3 and molecular weight 209.08 g/mol. IUPAC: (5-carbamoyl-1H-imidazol-4-yl) cyclobutanecarboxylate.
Chemical Property Profile of Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester
Property Insights of Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester
The XLogP value of 0.2141 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester. The TPSA of 98.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester. Following Lipinski's Rule of Five, Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester has 2 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 Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester?
The CAS number of Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester is 78682-38-9.
What is the molecular formula of Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester?
The molecular formula of Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester is C9H11N3O3.
What is the molecular weight of Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester?
The molecular weight of Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester is 209.08 g/mol.
Where can I buy Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester?
You can request a quote for Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclobutanecarboxylic acid, 5-(aminocarbonyl)-1H-imidazol-4-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.