2-(4-Methylphenyl)-4,6-dinitro-2H-indazole
TL;DR: 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole (CAS 401505-06-4) is a chemical compound with molecular formula C14H10N4O4 and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)-4,6-dinitroindazole
Also Known As: 2-(4-methylphenyl)-4,6-dinitroindazole, 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole, 2-N-(4-methylphenyl)-4,6-dinitroindazole, 4,6-bisnitro-2-(4-methylphenyl)-2H-indazole, 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole #
| Molecular Formula | C14H10N4O4 |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.0702 |
| Heavy Atoms | 22 |
| Complexity | 441.0 |
Chemical Identifiers
| CAS Number | 401505-06-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C=C3C(=CC(=CC3=N2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FUUDVFHHUBCDQB-UHFFFAOYSA-N |
Product Overview
2-(4-Methylphenyl)-4,6-dinitro-2H-indazole (CAS 401505-06-4), with molecular formula C14H10N4O4 and molecular weight 298.07 g/mol. IUPAC: 2-(4-methylphenyl)-4,6-dinitroindazole.
Chemical Property Profile of 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole
Property Insights of 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole
The XLogP value of 3.3 indicates that 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole. Following Lipinski's Rule of Five, 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole 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 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole?
The CAS number of 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole is 401505-06-4.
What is the molecular formula of 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole?
The molecular formula of 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole is C14H10N4O4.
What is the molecular weight of 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole?
The molecular weight of 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole is 298.07 g/mol.
Where can I buy 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole?
You can request a quote for 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylphenyl)-4,6-dinitro-2H-indazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.