![1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid structure](/static/products/797/797019-38-6.png)
1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid
TL;DR: 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid (CAS 797019-38-6) is a chemical compound with molecular formula C15H12N4O6S and molecular weight 376.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2-nitroanilino)-2-oxoethyl]benzimidazole-2-sulfonic acid
Also Known As: 1-[(2-nitrophenyl)carbamoylmethyl]benzoimidazole-2-sulfonic Acid, 1-[2-(2-nitroanilino)-2-oxoethyl]benzimidazole-2-sulfonic acid, 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid, 1-(2-((2-nitrophenyl)amino)-2-oxoethyl)-1H-benzo[d]imidazole-2-sulfonic acid
| Molecular Formula | C15H12N4O6S |
|---|---|
| Molecular Weight | 376.05 g/mol |
| LogP | 1.8299 |
| Topological Polar Surface Area | 144.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.04776 |
| Heavy Atoms | 26 |
| Complexity | 1122.122 |
Chemical Identifiers
| CAS Number | 797019-38-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(N2CC(=O)NC3=CC=CC=C3[N+](=O)[O-])S(=O)(=O)O |
Product Overview
1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid (CAS 797019-38-6), with molecular formula C15H12N4O6S and molecular weight 376.05 g/mol. IUPAC: 1-[2-(2-nitroanilino)-2-oxoethyl]benzimidazole-2-sulfonic acid.
Chemical Property Profile of 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid
Property Insights of 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid
The XLogP value of 1.8299 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid. The TPSA of 144.43 Ų indicates high polarity, suggesting 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid has 2 hydrogen bond donor(s) and 6 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 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid?
The CAS number of 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid is 797019-38-6.
What is the molecular formula of 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid?
The molecular formula of 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid is C15H12N4O6S.
What is the molecular weight of 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid?
The molecular weight of 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid is 376.05 g/mol.
Where can I buy 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid?
You can request a quote for 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-{2-[(2-nitrophenyl)amino]-2-oxoethyl}-1H-benzimidazole-2-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.