![1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- structure](/static/products/1091/1091-57-2.webp)
1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-
TL;DR: 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- (CAS 1091-57-2) is a chemical compound with molecular formula C13H9N3O4S and molecular weight 303.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)sulfonylbenzimidazole
Also Known As: 1-(4-nitrophenyl)sulfonylbenzimidazole, 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-, 1-(benzimidazolylsulfonyl)-4-nitrobenzene, 1-((4-Nitrophenyl)sulfonyl)-1h-benzo[d]imidazole, 1-[(4-nitrophenyl)sulfonyl]-1H-benzimidazole
| Molecular Formula | C13H9N3O4S |
|---|---|
| Molecular Weight | 303.03 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.03137 |
| Heavy Atoms | 21 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 1091-57-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=CN2S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | GJWWYZIOACBFIF-UHFFFAOYSA-N |
Product Overview
1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- (CAS 1091-57-2), with molecular formula C13H9N3O4S and molecular weight 303.03 g/mol. IUPAC: 1-(4-nitrophenyl)sulfonylbenzimidazole.
Chemical Property Profile of 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-
Property Insights of 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-. Following Lipinski's Rule of Five, 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- has 0 hydrogen bond donor(s) and 5 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 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-?
The CAS number of 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- is 1091-57-2.
What is the molecular formula of 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-?
The molecular formula of 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- is C13H9N3O4S.
What is the molecular weight of 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-?
The molecular weight of 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- is 303.03 g/mol.
Where can I buy 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-?
You can request a quote for 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole, 1-[(4-nitrophenyl)sulfonyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.