2-Tert-butyl-1-methylbenzimidazole
TL;DR: 2-Tert-butyl-1-methylbenzimidazole (CAS 178394-77-9) is a chemical compound with molecular formula C12H16N2 and molecular weight 188.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-1-methylbenzimidazole
Also Known As: 2-tert-butyl-1-methylbenzimidazole, 1-methyl-2-t-butylbenzimidazole, 1-methyl-2-tert-butyl-benzoimidazole, 2-(tert-butyl)-1-methyl-1H-benzo[d]imidazole, 2-tert-butyl-1-methyl-1H-1,3-benzodiazole
| Molecular Formula | C12H16N2 |
|---|---|
| Molecular Weight | 188.13 g/mol |
| LogP | 2.8708 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.13135 |
| Heavy Atoms | 14 |
| Complexity | 460.61673 |
Chemical Identifiers
| CAS Number | 178394-77-9 |
|---|---|
| SMILES | CC(C)(C)C1=NC2=CC=CC=C2N1C |
Product Overview
2-Tert-butyl-1-methylbenzimidazole (CAS 178394-77-9), with molecular formula C12H16N2 and molecular weight 188.13 g/mol. IUPAC: 2-tert-butyl-1-methylbenzimidazole.
Chemical Property Profile of 2-Tert-butyl-1-methylbenzimidazole
Property Insights of 2-Tert-butyl-1-methylbenzimidazole
The XLogP value of 2.8708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Tert-butyl-1-methylbenzimidazole. With a topological polar surface area (TPSA) of 17.82 Ų, 2-Tert-butyl-1-methylbenzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Tert-butyl-1-methylbenzimidazole has 0 hydrogen bond donor(s) and 1 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 2-Tert-butyl-1-methylbenzimidazole?
The CAS number of 2-Tert-butyl-1-methylbenzimidazole is 178394-77-9.
What is the molecular formula of 2-Tert-butyl-1-methylbenzimidazole?
The molecular formula of 2-Tert-butyl-1-methylbenzimidazole is C12H16N2.
What is the molecular weight of 2-Tert-butyl-1-methylbenzimidazole?
The molecular weight of 2-Tert-butyl-1-methylbenzimidazole is 188.13 g/mol.
Where can I buy 2-Tert-butyl-1-methylbenzimidazole?
You can request a quote for 2-Tert-butyl-1-methylbenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Tert-butyl-1-methylbenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Tert-butyl-1-methylbenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.