methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate
TL;DR: methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate (CAS 847181-71-9) is a chemical compound with molecular formula C14H16N2O5 and molecular weight 292.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(ethoxycarbonylamino)-6-methoxy-1H-indole-2-carboxylate
Also Known As: methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate, methyl 3-(ethoxycarbonylamino)-6-methoxy-1H-indole-2-carboxylate, methyl 3-[(ethoxycarbonyl)amino]-6-methoxy-1H-indole-2-carboxylate
| Molecular Formula | C14H16N2O5 |
|---|---|
| Molecular Weight | 292.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 89.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 292.10593 |
| Heavy Atoms | 21 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 847181-71-9 |
|---|---|
| SMILES | CCOC(=O)NC1=C(NC2=C1C=CC(=C2)OC)C(=O)OC |
| InChIKey | VPILOVWUIYFOIJ-UHFFFAOYSA-N |
Product Overview
methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate (CAS 847181-71-9), with molecular formula C14H16N2O5 and molecular weight 292.11 g/mol. IUPAC: methyl 3-(ethoxycarbonylamino)-6-methoxy-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate
Property Insights of methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 5 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 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate?
The CAS number of methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate is 847181-71-9.
What is the molecular formula of methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate?
The molecular formula of methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate is C14H16N2O5.
What is the molecular weight of methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate?
The molecular weight of methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate is 292.11 g/mol.
Where can I buy methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate?
You can request a quote for methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-((ethoxycarbonyl)amino)-6-methoxy-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.