1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine
TL;DR: 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine (CAS 193696-63-8) is a chemical compound with molecular formula C13H10N4O4S and molecular weight 318.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)sulfonylbenzimidazol-2-amine
Also Known As: ML130 Analog, 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine, (1-nosylbenzimidazol-2-yl)amine, 1-(4-nitrophenyl)sulfonylbenzimidazol-2-amine, 1-(4-nitrophenyl)sulfonyl-2-benzimidazolamine
| Molecular Formula | C13H10N4O4S |
|---|---|
| Molecular Weight | 318.04 g/mol |
| LogP | 1.7637 |
| Topological Polar Surface Area | 121.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.04227 |
| Heavy Atoms | 22 |
| Complexity | 976.9477 |
Chemical Identifiers
| CAS Number | 193696-63-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(N2S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])N |
Product Overview
1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine (CAS 193696-63-8), with molecular formula C13H10N4O4S and molecular weight 318.04 g/mol. IUPAC: 1-(4-nitrophenyl)sulfonylbenzimidazol-2-amine.
Chemical Property Profile of 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine
Property Insights of 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine
The XLogP value of 1.7637 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine. The TPSA of 121.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine. Following Lipinski's Rule of Five, 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine has 1 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-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine?
The CAS number of 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine is 193696-63-8.
What is the molecular formula of 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine?
The molecular formula of 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine is C13H10N4O4S.
What is the molecular weight of 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine?
The molecular weight of 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine is 318.04 g/mol.
Where can I buy 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine?
You can request a quote for 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.