2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole
TL;DR: 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole (CAS 438463-81-1) is a chemical compound with molecular formula C16H13N3O6 and molecular weight 343.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole
Also Known As: 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole, J3.569.092A, 1-(4,6-dinitroindol-2-yl)-2,3-dimethoxybenzene, 4,6-Dinitro-2-(2,3-dimethoxyphenyl)-1H-indole
| Molecular Formula | C16H13N3O6 |
|---|---|
| Molecular Weight | 343.08 g/mol |
| LogP | 3.6685 |
| Topological Polar Surface Area | 120.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.08044 |
| Heavy Atoms | 25 |
| Complexity | 994.9439 |
Chemical Identifiers
| CAS Number | 438463-81-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C2=CC3=C(N2)C=C(C=C3[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole (CAS 438463-81-1), with molecular formula C16H13N3O6 and molecular weight 343.08 g/mol. IUPAC: 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole.
Chemical Property Profile of 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole
Property Insights of 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole
The XLogP value of 3.6685 indicates that 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole. Following Lipinski's Rule of Five, 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole 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 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole?
The CAS number of 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole is 438463-81-1.
What is the molecular formula of 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole?
The molecular formula of 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole is C16H13N3O6.
What is the molecular weight of 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole?
The molecular weight of 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole is 343.08 g/mol.
Where can I buy 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole?
You can request a quote for 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3-dimethoxyphenyl)-4,6-dinitro-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.