![ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate structure](/static/products/799/799781-34-3.png)
ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate
TL;DR: ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate (CAS 799781-34-3) is a chemical compound with molecular formula C26H32N4O4 and molecular weight 464.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate
Also Known As: ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate, 3-[3-(4-benzylpiperazino)propanoylamino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester, ethyl 3-(3-(4-benzylpiperazin-1-yl)propanamido)-5-methoxy-1H-indole-2-carboxylate, ethyl 3-{[3-(4-benzylpiperazin-1-yl)propanoyl]amino}-5-methoxy-1H-indole-2-carboxylate, 5-methoxy-3-[[1-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]amino]-1H-indole-2-carboxylic acid ethyl ester
| Molecular Formula | C26H32N4O4 |
|---|---|
| Molecular Weight | 464.24 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 464.24237 |
| Heavy Atoms | 34 |
| Complexity | 663.0 |
Chemical Identifiers
| CAS Number | 799781-34-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CCN3CCN(CC3)CC4=CC=CC=C4 |
| InChIKey | JACYVLVQJKEIQR-UHFFFAOYSA-N |
Product Overview
ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate (CAS 799781-34-3), with molecular formula C26H32N4O4 and molecular weight 464.24 g/mol. IUPAC: ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate.
Chemical Property Profile of ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate
Property Insights of ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate
The XLogP value of 3.6 indicates that ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 6 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 ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate?
The CAS number of ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate is 799781-34-3.
What is the molecular formula of ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate?
The molecular formula of ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate is C26H32N4O4.
What is the molecular weight of ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate?
The molecular weight of ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate is 464.24 g/mol.
Where can I buy ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate?
You can request a quote for ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-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 ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.