(E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate
TL;DR: (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate (CAS 89607-73-8) is a chemical compound with molecular formula C14H18N4O3 and molecular weight 290.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(dimethylaminodiazenyl)-5-methoxy-1H-indole-2-carboxylate
Also Known As: BAS 00411468, (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate, ethyl 3-(dimethylaminohydrazinylidene)-5-methoxyindole-2-carboxylate, ethyl (3Z)-3-(dimethylaminohydrazinylidene)-5-methoxyindole-2-carboxylate, ethyl 3-[(1E)-3,3-dimethyltriaz-1-en-1-yl]-5-methoxy-1H-indole-2-carboxylate
| Molecular Formula | C14H18N4O3 |
|---|---|
| Molecular Weight | 290.14 g/mol |
| LogP | 2.9135 |
| Topological Polar Surface Area | 79.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.13788 |
| Heavy Atoms | 21 |
| Complexity | 676.1541 |
Chemical Identifiers
| CAS Number | 89607-73-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)N=NN(C)C |
Product Overview
(E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate (CAS 89607-73-8), with molecular formula C14H18N4O3 and molecular weight 290.14 g/mol. IUPAC: ethyl 3-(dimethylaminodiazenyl)-5-methoxy-1H-indole-2-carboxylate.
Chemical Property Profile of (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate
Property Insights of (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate
The XLogP value of 2.9135 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate. The TPSA of 79.28 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate has 1 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 (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate?
The CAS number of (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate is 89607-73-8.
What is the molecular formula of (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate?
The molecular formula of (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate is C14H18N4O3.
What is the molecular weight of (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate?
The molecular weight of (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate is 290.14 g/mol.
Where can I buy (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate?
You can request a quote for (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-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 (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 3-(3,3-dimethyltriaz-1-en-1-yl)-5-methoxy-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.