1H-benzimidazole-4,7-dione
TL;DR: 1H-benzimidazole-4,7-dione (CAS 7795-89-3) is a chemical compound with molecular formula C7H4N2O2 and molecular weight 148.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-benzimidazole-4,7-dione
Also Known As: 4,7-Benzimidazoledione, 1h-benzimidazole-4,7-dione, benzimidazole-4,7-quinone, 4,7-benzimidazolequinone, benzimidazole-4,7-dione
| Molecular Formula | C7H4N2O2 |
|---|---|
| Molecular Weight | 148.03 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.02728 |
| Heavy Atoms | 11 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 7795-89-3 |
|---|---|
| SMILES | C1=CC(=O)C2=C(C1=O)NC=N2 |
| InChIKey | UVXXFOQQHBSTIC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-benzimidazole-4,7-dione (CAS 7795-89-3), with molecular formula C7H4N2O2 and molecular weight 148.03 g/mol. IUPAC: 1H-benzimidazole-4,7-dione.
Chemical Property Profile of 1H-benzimidazole-4,7-dione
Property Insights of 1H-benzimidazole-4,7-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-benzimidazole-4,7-dione. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-benzimidazole-4,7-dione. Following Lipinski's Rule of Five, 1H-benzimidazole-4,7-dione has 1 hydrogen bond donor(s) and 3 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-4,7-dione?
The CAS number of 1H-benzimidazole-4,7-dione is 7795-89-3.
What is the molecular formula of 1H-benzimidazole-4,7-dione?
The molecular formula of 1H-benzimidazole-4,7-dione is C7H4N2O2.
What is the molecular weight of 1H-benzimidazole-4,7-dione?
The molecular weight of 1H-benzimidazole-4,7-dione is 148.03 g/mol.
Where can I buy 1H-benzimidazole-4,7-dione?
You can request a quote for 1H-benzimidazole-4,7-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-benzimidazole-4,7-dione?
Yes, KEHONG BIO provides custom synthesis services for 1H-benzimidazole-4,7-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.