ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate
TL;DR: ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate (CAS 843670-62-2) is a chemical compound with molecular formula C25H28Cl2N4O5 and molecular weight 534.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-5,6-dimethoxy-1H-indole-2-carboxylate
Also Known As: ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate, ethyl 3-(2-(4-(3,4-dichlorophenyl)piperazin-1-yl)acetamido)-5,6-dimethoxy-1H-indole-2-carboxylate, ethyl 3-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-5,6-dimethoxy-1H-indole-2-carboxylate
| Molecular Formula | C25H28Cl2N4O5 |
|---|---|
| Molecular Weight | 534.14 g/mol |
| LogP | 4.4293 |
| Topological Polar Surface Area | 96.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 534.1437 |
| Heavy Atoms | 36 |
| Complexity | 1271.0583 |
Chemical Identifiers
| CAS Number | 843670-62-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CN3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl |
Product Overview
ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate (CAS 843670-62-2), with molecular formula C25H28Cl2N4O5 and molecular weight 534.14 g/mol. IUPAC: ethyl 3-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-5,6-dimethoxy-1H-indole-2-carboxylate.
Chemical Property Profile of ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate
Property Insights of ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate
The XLogP value of 4.4293 indicates that ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate?
The CAS number of ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate is 843670-62-2.
What is the molecular formula of ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate?
The molecular formula of ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate is C25H28Cl2N4O5.
What is the molecular weight of ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate?
The molecular weight of ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate is 534.14 g/mol.
Where can I buy ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate?
You can request a quote for ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-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 ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-({[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.