Methyl N-methylindole-6-carboxylate
TL;DR: Methyl N-methylindole-6-carboxylate (CAS 247128-24-1) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-methylindole-6-carboxylate
Also Known As: methyl 1-methylindole-6-carboxylate, methyl 1-methyl-1H-indole-6-carboxylate, null, Methyl N-methylindole-6-carboxylate, N-Methylindole-6-carboxylic acid methyl ester
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 247128-24-1 |
|---|---|
| SMILES | CN1C=CC2=C1C=C(C=C2)C(=O)OC |
| InChIKey | NMILWYUYIFMKTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl N-methylindole-6-carboxylate (CAS 247128-24-1), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: methyl 1-methylindole-6-carboxylate.
Chemical Property Profile of Methyl N-methylindole-6-carboxylate
Property Insights of Methyl N-methylindole-6-carboxylate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-methylindole-6-carboxylate. With a topological polar surface area (TPSA) of 31.2 Ų, Methyl N-methylindole-6-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl N-methylindole-6-carboxylate has 0 hydrogen bond donor(s) and 2 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 Methyl N-methylindole-6-carboxylate?
The CAS number of Methyl N-methylindole-6-carboxylate is 247128-24-1.
What is the molecular formula of Methyl N-methylindole-6-carboxylate?
The molecular formula of Methyl N-methylindole-6-carboxylate is C11H11NO2.
What is the molecular weight of Methyl N-methylindole-6-carboxylate?
The molecular weight of Methyl N-methylindole-6-carboxylate is 189.08 g/mol.
Where can I buy Methyl N-methylindole-6-carboxylate?
You can request a quote for Methyl N-methylindole-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N-methylindole-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-methylindole-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.