(E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate
TL;DR: (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate (CAS 577962-60-8) is a chemical compound with molecular formula C17H13Cl5N2O4 and molecular weight 483.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methoxy-3-[[(2E)-2,3,4,5,5-pentachloropenta-2,4-dienoyl]amino]-1H-indole-2-carboxylate
Also Known As: (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate, Ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienoylamino)-1H-indole-2-carboxylate, ethyl 5-methoxy-3-[[(2E)-2,3,4,5,5-pentachloropenta-2,4-dienoyl]amino]-1H-indole-2-carboxylate, ethyl 5-methoxy-3-{[(2E)-2,3,4,5,5-pentachloropenta-2,4-dienoyl]amino}-1H-indole-2-carboxylate
| Molecular Formula | C17H13Cl5N2O4 |
|---|---|
| Molecular Weight | 483.93 g/mol |
| LogP | 5.8664 |
| Topological Polar Surface Area | 80.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 483.9318 |
| Heavy Atoms | 28 |
| Complexity | 992.83936 |
Chemical Identifiers
| CAS Number | 577962-60-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)/C(=C(/C(=C(Cl)Cl)Cl)\Cl)/Cl |
Product Overview
(E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate (CAS 577962-60-8), with molecular formula C17H13Cl5N2O4 and molecular weight 483.93 g/mol. IUPAC: ethyl 5-methoxy-3-[[(2E)-2,3,4,5,5-pentachloropenta-2,4-dienoyl]amino]-1H-indole-2-carboxylate.
Chemical Property Profile of (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate
Property Insights of (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate
The XLogP value of 5.8664 indicates that (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.42 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate?
The CAS number of (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate is 577962-60-8.
What is the molecular formula of (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate?
The molecular formula of (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate is C17H13Cl5N2O4.
What is the molecular weight of (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate?
The molecular weight of (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate is 483.93 g/mol.
Where can I buy (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate?
You can request a quote for (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-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 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 5-methoxy-3-(2,3,4,5,5-pentachloropenta-2,4-dienamido)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.