1H-Indole, 5-methoxy-2,3-dimethyl-
TL;DR: 1H-Indole, 5-methoxy-2,3-dimethyl- (CAS 828-94-4) is a chemical compound with molecular formula C11H13NO and molecular weight 175.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2,3-dimethyl-1H-indole
Also Known As: 5-Methoxy-2,3-dimethyl-1H-indole, 5-Methoxy-2,3-dimethylindole, Indometacin Impurity 26, 2,3-dimethyl-5-methoxyindole, Indomethacin Impurity 24
| Molecular Formula | C11H13NO |
|---|---|
| Molecular Weight | 175.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 25.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.09972 |
| Heavy Atoms | 13 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 828-94-4 |
|---|---|
| SMILES | CC1=C(NC2=C1C=C(C=C2)OC)C |
| InChIKey | GZSTUEGIANKNTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Indole, 5-methoxy-2,3-dimethyl- (CAS 828-94-4), with molecular formula C11H13NO and molecular weight 175.10 g/mol. IUPAC: 5-methoxy-2,3-dimethyl-1H-indole.
Chemical Property Profile of 1H-Indole, 5-methoxy-2,3-dimethyl-
Property Insights of 1H-Indole, 5-methoxy-2,3-dimethyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole, 5-methoxy-2,3-dimethyl-. With a topological polar surface area (TPSA) of 25.0 Ų, 1H-Indole, 5-methoxy-2,3-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole, 5-methoxy-2,3-dimethyl- has 1 hydrogen bond donor(s) and 1 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-Indole, 5-methoxy-2,3-dimethyl-?
The CAS number of 1H-Indole, 5-methoxy-2,3-dimethyl- is 828-94-4.
What is the molecular formula of 1H-Indole, 5-methoxy-2,3-dimethyl-?
The molecular formula of 1H-Indole, 5-methoxy-2,3-dimethyl- is C11H13NO.
What is the molecular weight of 1H-Indole, 5-methoxy-2,3-dimethyl-?
The molecular weight of 1H-Indole, 5-methoxy-2,3-dimethyl- is 175.10 g/mol.
Where can I buy 1H-Indole, 5-methoxy-2,3-dimethyl-?
You can request a quote for 1H-Indole, 5-methoxy-2,3-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole, 5-methoxy-2,3-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole, 5-methoxy-2,3-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.