1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester
TL;DR: 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester (CAS 89562-38-9) is a chemical compound with molecular formula C12H17N3O3 and molecular weight 251.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(piperidine-1-carbonyl)-1H-imidazole-5-carboxylate
Also Known As: BIM-0000571.P001, 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester, ethyl 4-(piperidine-1-carbonyl)-1H-imidazole-5-carboxylate, AF-399/15285002, ethyl 4-(1-piperidinylcarbonyl)-1H-imidazole-5-carboxylate
| Molecular Formula | C12H17N3O3 |
|---|---|
| Molecular Weight | 251.13 g/mol |
| LogP | 1.2125 |
| Topological Polar Surface Area | 75.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.127 |
| Heavy Atoms | 18 |
| Complexity | 435.53098 |
Chemical Identifiers
| CAS Number | 89562-38-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=CN1)C(=O)N2CCCCC2 |
Product Overview
1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester (CAS 89562-38-9), with molecular formula C12H17N3O3 and molecular weight 251.13 g/mol. IUPAC: ethyl 4-(piperidine-1-carbonyl)-1H-imidazole-5-carboxylate.
Chemical Property Profile of 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester
Property Insights of 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester
The XLogP value of 1.2125 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester. The TPSA of 75.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester. Following Lipinski's Rule of Five, 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester has 1 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 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester?
The CAS number of 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester is 89562-38-9.
What is the molecular formula of 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester?
The molecular formula of 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester is C12H17N3O3.
What is the molecular weight of 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester?
The molecular weight of 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester is 251.13 g/mol.
Where can I buy 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester?
You can request a quote for 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole-4-carboxylic acid, 5-(1-piperidinylcarbonyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.