2-phenyl-1H-benzimidazole-5-sulfonate
TL;DR: 2-phenyl-1H-benzimidazole-5-sulfonate (CAS 158099-19-5) is a chemical compound with molecular formula C13H9N2O3S- and molecular weight 273.0334 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenyl-3H-benzimidazole-5-sulfonate
Also Known As: 2-phenyl-1H-benzimidazole-5-sulfonate, 2-Phenyl-1H-benzimidazole-6-sulfonate, 2-phenyl-3H-benzimidazole-5-sulfonate, BAS 00511831, 2-phenyl-1H-benzimidazole-5-sulfonic acid
Technical Specifications
| Molecular Formula | C13H9N2O3S- |
| Molecular Weight | 273.0334 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 94.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.0334 Da |
| Heavy Atoms | 19 |
| Complexity | 401.0 |
| SMILES | C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)[O-] |
| InChIKey | UVCJGUGAGLDPAA-UHFFFAOYSA-M |
Chemical Property Profile of 2-phenyl-1H-benzimidazole-5-sulfonate
Property Insights of 2-phenyl-1H-benzimidazole-5-sulfonate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-phenyl-1H-benzimidazole-5-sulfonate. The TPSA of 94.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-phenyl-1H-benzimidazole-5-sulfonate. Following Lipinski's Rule of Five, 2-phenyl-1H-benzimidazole-5-sulfonate 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
What is the CAS number of 2-phenyl-1H-benzimidazole-5-sulfonate?
The CAS number of 2-phenyl-1H-benzimidazole-5-sulfonate is 158099-19-5.
What is the molecular formula of 2-phenyl-1H-benzimidazole-5-sulfonate?
The molecular formula of 2-phenyl-1H-benzimidazole-5-sulfonate is C13H9N2O3S-.
What is the molecular weight of 2-phenyl-1H-benzimidazole-5-sulfonate?
The molecular weight of 2-phenyl-1H-benzimidazole-5-sulfonate is 273.0334 g/mol.
Where can I buy 2-phenyl-1H-benzimidazole-5-sulfonate?
You can request a quote for 2-phenyl-1H-benzimidazole-5-sulfonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-phenyl-1H-benzimidazole-5-sulfonate?
Yes, CoreyChem provides custom synthesis services for 2-phenyl-1H-benzimidazole-5-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.