3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid
TL;DR: 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid (CAS 883549-92-6) 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.
3-(4,6-dimethyl-1H-benzimidazol-2-yl)propanoic acid
Also Known As: 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid, 3-(5,7-Dimethyl-1H-benzo[d]imidazol-2-yl)propanoic acid, BAS 10157159, 3-(4,6-dimethyl-1H-benzimidazol-2-yl)propanoic acid, 3-(5,7-dimethylbenzimidazol-2-yl)propanoic acid
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 2.19694 |
| Topological Polar Surface Area | 65.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 543.1875 |
Chemical Identifiers
| CAS Number | 883549-92-6 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)NC(=N2)CCC(=O)O)C |
Product Overview
3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid (CAS 883549-92-6), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 3-(4,6-dimethyl-1H-benzimidazol-2-yl)propanoic acid.
Chemical Property Profile of 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid
Property Insights of 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid
The XLogP value of 2.19694 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid. The TPSA of 65.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid. Following Lipinski's Rule of Five, 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid has 2 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 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid?
The CAS number of 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid is 883549-92-6.
What is the molecular formula of 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid?
The molecular formula of 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid is C12H14N2O2.
What is the molecular weight of 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid?
The molecular weight of 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid is 218.11 g/mol.
Where can I buy 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid?
You can request a quote for 3-(5,7-Dimethyl-1H-benzoimidazol-2-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 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5,7-Dimethyl-1H-benzoimidazol-2-yl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.