7-ethyl-2,3-dimethyl-1H-indole
TL;DR: 7-ethyl-2,3-dimethyl-1H-indole (CAS 94239-12-0) is a chemical compound with molecular formula C12H15N and molecular weight 173.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethyl-2,3-dimethyl-1H-indole
Also Known As: 7-ethyl-2,3-dimethyl-1H-indole, 2,3-Dimethyl-7-ethyl-1H-indole, J2.174.813G
| Molecular Formula | C12H15N |
|---|---|
| Molecular Weight | 173.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.12045 |
| Heavy Atoms | 13 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 94239-12-0 |
|---|---|
| SMILES | CCC1=C2C(=CC=C1)C(=C(N2)C)C |
| InChIKey | LLEKOBMUOOLVPZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-ethyl-2,3-dimethyl-1H-indole (CAS 94239-12-0), with molecular formula C12H15N and molecular weight 173.12 g/mol. IUPAC: 7-ethyl-2,3-dimethyl-1H-indole.
Chemical Property Profile of 7-ethyl-2,3-dimethyl-1H-indole
Property Insights of 7-ethyl-2,3-dimethyl-1H-indole
The XLogP value of 3.6 indicates that 7-ethyl-2,3-dimethyl-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.8 Ų, 7-ethyl-2,3-dimethyl-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-ethyl-2,3-dimethyl-1H-indole 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 7-ethyl-2,3-dimethyl-1H-indole?
The CAS number of 7-ethyl-2,3-dimethyl-1H-indole is 94239-12-0.
What is the molecular formula of 7-ethyl-2,3-dimethyl-1H-indole?
The molecular formula of 7-ethyl-2,3-dimethyl-1H-indole is C12H15N.
What is the molecular weight of 7-ethyl-2,3-dimethyl-1H-indole?
The molecular weight of 7-ethyl-2,3-dimethyl-1H-indole is 173.12 g/mol.
Where can I buy 7-ethyl-2,3-dimethyl-1H-indole?
You can request a quote for 7-ethyl-2,3-dimethyl-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-ethyl-2,3-dimethyl-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 7-ethyl-2,3-dimethyl-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.