5-Methoxy-2,3-dimethyl-6-nitro-1H-indole
TL;DR: 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole (CAS 53918-83-5) is a chemical compound with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2,3-dimethyl-6-nitro-1H-indole
Also Known As: 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole, 5-methoxy-2,3-dimethyl-6-nitroindole, 6-Nitro-5-methoxy-2,3-dimethylindole, 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole #, 2,3-DIMETHYL-6-NITRO-5-TRIDEUTEROMETHOXYINDOLE
| Molecular Formula | C11H12N2O3 |
|---|---|
| Molecular Weight | 220.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.0848 |
| Heavy Atoms | 16 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 53918-83-5 |
|---|---|
| SMILES | CC1=C(NC2=CC(=C(C=C12)OC)[N+](=O)[O-])C |
| InChIKey | ZLSBCSFIBGGDQS-UHFFFAOYSA-N |
Product Overview
5-Methoxy-2,3-dimethyl-6-nitro-1H-indole (CAS 53918-83-5), with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol. IUPAC: 5-methoxy-2,3-dimethyl-6-nitro-1H-indole.
Chemical Property Profile of 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole
Property Insights of 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole. Following Lipinski's Rule of Five, 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole 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 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole?
The CAS number of 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole is 53918-83-5.
What is the molecular formula of 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole?
The molecular formula of 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole is C11H12N2O3.
What is the molecular weight of 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole?
The molecular weight of 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole is 220.08 g/mol.
Where can I buy 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole?
You can request a quote for 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 5-Methoxy-2,3-dimethyl-6-nitro-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.