2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester
TL;DR: 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester (CAS 151490-40-3) is a chemical compound with molecular formula C12H11NO3 and molecular weight 217.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(1-methylindol-3-yl)-2-oxoacetate
Also Known As: zlchem 1011, Methyl (1-methylindolyl)-3-glyoxylate, 3-Methoxy-2-methylpyridine, 2-(1-METHYL-1H-INDOL-3-YL)-2-OXOACETIC ACID METHYL ESTER, methyl 2-(1-methyl-1H-indol-3-yl)-2-oxoacetate
Technical Specifications
| Molecular Formula | C12H11NO3 |
| Molecular Weight | 217.0739 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.0739 Da |
| Heavy Atoms | 16 |
| Complexity | 303.0 |
| SMILES | CN1C=C(C2=CC=CC=C21)C(=O)C(=O)OC |
| InChIKey | SBHIWUQNUXJUMN-UHFFFAOYSA-N |
Chemical Property Profile of 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester
Property Insights of 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester. With a topological polar surface area (TPSA) of 48.3 Ų, 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester?
The CAS number of 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester is 151490-40-3.
What is the molecular formula of 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester?
The molecular formula of 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester is C12H11NO3.
What is the molecular weight of 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester?
The molecular weight of 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester is 217.0739 g/mol.
Where can I buy 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester?
You can request a quote for 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester?
Yes, CoreyChem provides custom synthesis services for 2-(1-Methyl-1H-indol-3-YL)-2-oxoacetic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.