4-Chloro-6-methoxyindole
TL;DR: 4-Chloro-6-methoxyindole (CAS 93490-31-4) is a chemical compound with molecular formula C9H8ClNO and molecular weight 181.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-6-methoxy-1H-indole
Also Known As: 4-chloro-6-methoxy-1H-indole, 4-Chloro-6-methoxyindole, 4-Chloro-6-methoxy indole, 1H-Indole, 4-chloro-6-methoxy-, 4-chloro-6-methoxy-indole
| Molecular Formula | C9H8ClNO |
|---|---|
| Molecular Weight | 181.03 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 25.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.02943 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 93490-31-4 |
|---|---|
| SMILES | COC1=CC2=C(C=CN2)C(=C1)Cl |
| InChIKey | ROZQWTXWGPFHST-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-6-methoxyindole (CAS 93490-31-4), with molecular formula C9H8ClNO and molecular weight 181.03 g/mol. IUPAC: 4-chloro-6-methoxy-1H-indole.
Chemical Property Profile of 4-Chloro-6-methoxyindole
Property Insights of 4-Chloro-6-methoxyindole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-6-methoxyindole. With a topological polar surface area (TPSA) of 25.0 Ų, 4-Chloro-6-methoxyindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-6-methoxyindole 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 4-Chloro-6-methoxyindole?
The CAS number of 4-Chloro-6-methoxyindole is 93490-31-4.
What is the molecular formula of 4-Chloro-6-methoxyindole?
The molecular formula of 4-Chloro-6-methoxyindole is C9H8ClNO.
What is the molecular weight of 4-Chloro-6-methoxyindole?
The molecular weight of 4-Chloro-6-methoxyindole is 181.03 g/mol.
Where can I buy 4-Chloro-6-methoxyindole?
You can request a quote for 4-Chloro-6-methoxyindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-6-methoxyindole?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-6-methoxyindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.