1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride
TL;DR: 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride (CAS 139261-79-3) is a chemical compound with molecular formula C12H20ClN3O2 and molecular weight 273.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-2-piperidin-1-yl-1H-imidazole-4-carboxylate;hydrochloride
Also Known As: 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride, Ethyl 2-(N-piperidino)-4(5)-methyl-5(4)-imidazolecarboxylate hydrochloride, Ethyl 5-methyl-2-(1-piperidinyl)-1H-imidazole-4-carboxylate monohydrochloride, ethyl 5-methyl-2-piperidin-1-yl-1H-imidazole-4-carboxylate hydrochloride, Ethyl 5-methyl-2-(piperidin-1-yl)-1H-imidazole-4-carboxylate--hydrogen chloride (1/1)
| Molecular Formula | C12H20ClN3O2 |
|---|---|
| Molecular Weight | 273.12 g/mol |
| LogP | 2.30692 |
| Topological Polar Surface Area | 58.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.1244 |
| Heavy Atoms | 18 |
| Complexity | 400.02682 |
Chemical Identifiers
| CAS Number | 139261-79-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=N1)N2CCCCC2)C.Cl |
Product Overview
1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride (CAS 139261-79-3), with molecular formula C12H20ClN3O2 and molecular weight 273.12 g/mol. IUPAC: ethyl 5-methyl-2-piperidin-1-yl-1H-imidazole-4-carboxylate;hydrochloride.
Chemical Property Profile of 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride
Property Insights of 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride
The XLogP value of 2.30692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride. With a topological polar surface area (TPSA) of 58.22 Ų, 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride 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-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride?
The CAS number of 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride is 139261-79-3.
What is the molecular formula of 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride?
The molecular formula of 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride is C12H20ClN3O2.
What is the molecular weight of 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride?
The molecular weight of 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride is 273.12 g/mol.
Where can I buy 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride?
You can request a quote for 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride 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-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole-4-carboxylic acid, 5-methyl-2-(1-piperidinyl)-, ethyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.