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1h-Naphtho[2,3-d]imidazole-4,9-dione
TL;DR: 1h-Naphtho[2,3-d]imidazole-4,9-dione (CAS 4496-30-4) is a chemical compound with molecular formula C11H6N2O2 and molecular weight 198.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-benzo[f]benzimidazole-4,9-dione
Also Known As: 1h-naphtho[2,3-d]imidazole-4,9-dione, 1H-benzo[f]benzimidazole-4,9-dione, 1H-Naphth[2,3-d]imidazole-4,9-dione, naphtho[2,3-d]imidazole-4,9-dione, 1H-benzo[f]benzimidazole-4,9-quinone
| Molecular Formula | C11H6N2O2 |
|---|---|
| Molecular Weight | 198.04 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.04292 |
| Heavy Atoms | 15 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 4496-30-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)N=CN3 |
| InChIKey | ABVGDXLCJRFCOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1h-Naphtho[2,3-d]imidazole-4,9-dione (CAS 4496-30-4), with molecular formula C11H6N2O2 and molecular weight 198.04 g/mol. IUPAC: 1H-benzo[f]benzimidazole-4,9-dione.
Chemical Property Profile of 1h-Naphtho[2,3-d]imidazole-4,9-dione
Property Insights of 1h-Naphtho[2,3-d]imidazole-4,9-dione
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1h-Naphtho[2,3-d]imidazole-4,9-dione. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1h-Naphtho[2,3-d]imidazole-4,9-dione. Following Lipinski's Rule of Five, 1h-Naphtho[2,3-d]imidazole-4,9-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-Naphtho[2,3-d]imidazole-4,9-dione?
The CAS number of 1h-Naphtho[2,3-d]imidazole-4,9-dione is 4496-30-4.
What is the molecular formula of 1h-Naphtho[2,3-d]imidazole-4,9-dione?
The molecular formula of 1h-Naphtho[2,3-d]imidazole-4,9-dione is C11H6N2O2.
What is the molecular weight of 1h-Naphtho[2,3-d]imidazole-4,9-dione?
The molecular weight of 1h-Naphtho[2,3-d]imidazole-4,9-dione is 198.04 g/mol.
Where can I buy 1h-Naphtho[2,3-d]imidazole-4,9-dione?
You can request a quote for 1h-Naphtho[2,3-d]imidazole-4,9-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1h-Naphtho[2,3-d]imidazole-4,9-dione?
Yes, KEHONG BIO provides custom synthesis services for 1h-Naphtho[2,3-d]imidazole-4,9-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.