2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid
TL;DR: 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid (CAS 78706-19-1) is a chemical compound with molecular formula C13H12N2O3S2 and molecular weight 308.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(1-methylbenzimidazol-2-yl)thiophene-3-sulfonic acid
Also Known As: BAS 07310615, 2-methyl-5-(1-methyl-1H-benzo[d]imidazol-2-yl)thiophene-3-sulfonic acid, 2-methyl-5-(1-methylbenzimidazol-2-yl)thiophene-3-sulfonic acid, 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid, 2-Methyl-5-(1-methyl-1H-benzoimidazol-2-yl)-thiophene-3-sulfonic acid
| Molecular Formula | C13H12N2O3S2 |
|---|---|
| Molecular Weight | 308.03 g/mol |
| LogP | 2.85692 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.02893 |
| Heavy Atoms | 20 |
| Complexity | 906.9891 |
Chemical Identifiers
| CAS Number | 78706-19-1 |
|---|---|
| SMILES | CC1=C(C=C(S1)C2=NC3=CC=CC=C3N2C)S(=O)(=O)O |
Product Overview
2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid (CAS 78706-19-1), with molecular formula C13H12N2O3S2 and molecular weight 308.03 g/mol. IUPAC: 2-methyl-5-(1-methylbenzimidazol-2-yl)thiophene-3-sulfonic acid.
Chemical Property Profile of 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid
Property Insights of 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid
The XLogP value of 2.85692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid. Following Lipinski's Rule of Five, 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid has 1 hydrogen bond donor(s) and 4 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-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid?
The CAS number of 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid is 78706-19-1.
What is the molecular formula of 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid?
The molecular formula of 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid is C13H12N2O3S2.
What is the molecular weight of 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid?
The molecular weight of 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid is 308.03 g/mol.
Where can I buy 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid?
You can request a quote for 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic 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-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-5-(1-methyl-1H-benzimidazol-2-yl)thiophene-3-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.