Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate
TL;DR: Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate (CAS 306278-47-7) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate
Also Known As: methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate, Methyl 1-ethyl-2-methyl-1H-benzo[d]imidazole-5-carboxylate, SDCCGSBI-0660739.P001, BAS 00569794, methyl 1-ethyl-2-methyl-1H-1,3-benzodiazole-5-carboxylate
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 44.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 306278-47-7 |
|---|---|
| SMILES | CCN1C(=NC2=C1C=CC(=C2)C(=O)OC)C |
| InChIKey | CLJIRVRIUQJCQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate (CAS 306278-47-7), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate.
Chemical Property Profile of Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate
Property Insights of Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate. With a topological polar surface area (TPSA) of 44.1 Ų, Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate has 0 hydrogen bond donor(s) and 3 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 Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate?
The CAS number of Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate is 306278-47-7.
What is the molecular formula of Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate?
The molecular formula of Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate is C12H14N2O2.
What is the molecular weight of Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate?
The molecular weight of Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate is 218.11 g/mol.
Where can I buy Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate?
You can request a quote for Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-ethyl-2-methylbenzimidazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.