5,7-Dimethylindole
TL;DR: 5,7-Dimethylindole (CAS 54020-53-0) is a chemical compound with molecular formula C10H11N and molecular weight 145.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethyl-1H-indole
Also Known As: 5,7-Dimethyl-1H-indole, 5,7-Dimethylindole, Ruscogenin, 1H-Indole, 5,7-dimethyl-, 5,7-Dimethyl-1H-indole #
| Molecular Formula | C10H11N |
|---|---|
| Molecular Weight | 145.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 145.08914 |
| Heavy Atoms | 11 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 54020-53-0 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)C=CN2)C |
| InChIKey | DVHNMQQXLMOZKB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,7-Dimethylindole (CAS 54020-53-0), with molecular formula C10H11N and molecular weight 145.09 g/mol. IUPAC: 5,7-dimethyl-1H-indole.
Chemical Property Profile of 5,7-Dimethylindole
Property Insights of 5,7-Dimethylindole
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,7-Dimethylindole. With a topological polar surface area (TPSA) of 15.8 Ų, 5,7-Dimethylindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,7-Dimethylindole has 1 hydrogen bond donor(s) and 0 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 5,7-Dimethylindole?
The CAS number of 5,7-Dimethylindole is 54020-53-0.
What is the molecular formula of 5,7-Dimethylindole?
The molecular formula of 5,7-Dimethylindole is C10H11N.
What is the molecular weight of 5,7-Dimethylindole?
The molecular weight of 5,7-Dimethylindole is 145.09 g/mol.
Where can I buy 5,7-Dimethylindole?
You can request a quote for 5,7-Dimethylindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7-Dimethylindole?
Yes, KEHONG BIO provides custom synthesis services for 5,7-Dimethylindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.