2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid
TL;DR: 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid (CAS 58555-20-7) 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.
2-methyl-3-(2-methylbenzimidazol-1-yl)propanoic acid
Also Known As: 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid, BAS 10149507, 2-methyl-3-(2-methylbenzimidazol-1-yl)propanoic acid, BB 0219321, 2-methyl-3-(2-methyl-1H-1,3-benzodiazol-1-yl)propanoic acid
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 2.06542 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 530.79834 |
Chemical Identifiers
| CAS Number | 58555-20-7 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2N1CC(C)C(=O)O |
Product Overview
2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid (CAS 58555-20-7), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 2-methyl-3-(2-methylbenzimidazol-1-yl)propanoic acid.
Chemical Property Profile of 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid
Property Insights of 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid
The XLogP value of 2.06542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid. With a topological polar surface area (TPSA) of 55.12 Ų, 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid has 1 hydrogen bond donor(s) and 2 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-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid?
The CAS number of 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid is 58555-20-7.
What is the molecular formula of 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid?
The molecular formula of 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid is C12H14N2O2.
What is the molecular weight of 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid?
The molecular weight of 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid is 218.11 g/mol.
Where can I buy 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid?
You can request a quote for 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-(2-methyl-benzoimidazol-1-yl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.