![2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid structure](/static/products/7280/728035-45-8.webp)
2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid
TL;DR: 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid (CAS 728035-45-8) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Also Known As: 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid, 2-((6-Methyl-1H-benzo[d]imidazol-2-yl)thio)propanoic acid, 8824AE, BAS 12398417, 2-(6-Methyl-1H-benzoimidazol-2-ylsulfanyl)-propionic acid
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 2.43652 |
| Topological Polar Surface Area | 65.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 535.7641 |
Chemical Identifiers
| CAS Number | 728035-45-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)O |
Product Overview
2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid (CAS 728035-45-8), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanoic acid.
Chemical Property Profile of 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid
Property Insights of 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid
The XLogP value of 2.43652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid. The TPSA of 65.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid. Following Lipinski's Rule of Five, 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid has 2 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 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid?
The CAS number of 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid is 728035-45-8.
What is the molecular formula of 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid?
The molecular formula of 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid is C11H12N2O2S.
What is the molecular weight of 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid?
The molecular weight of 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid is 236.06 g/mol.
Where can I buy 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid?
You can request a quote for 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(6-Methyl-1H-benzimidazol-2-yl)thio]-propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.