ethyl 3-(1H-indol-3-yl)-5-oxohexanoate
TL;DR: ethyl 3-(1H-indol-3-yl)-5-oxohexanoate (CAS 32897-74-8) is a chemical compound with molecular formula C16H19NO3 and molecular weight 273.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(1H-indol-3-yl)-5-oxohexanoate
Also Known As: ethyl 3-(1H-indol-3-yl)-5-oxohexanoate, ethyl 3-indol-3-yl-5-oxohexanoate
| Molecular Formula | C16H19NO3 |
|---|---|
| Molecular Weight | 273.14 g/mol |
| LogP | 3.1838 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 273.1365 |
| Heavy Atoms | 20 |
| Complexity | 614.9644 |
Chemical Identifiers
| CAS Number | 32897-74-8 |
|---|---|
| SMILES | CCOC(=O)CC(CC(=O)C)C1=CNC2=CC=CC=C21 |
Product Overview
ethyl 3-(1H-indol-3-yl)-5-oxohexanoate (CAS 32897-74-8), with molecular formula C16H19NO3 and molecular weight 273.14 g/mol. IUPAC: ethyl 3-(1H-indol-3-yl)-5-oxohexanoate.
Chemical Property Profile of ethyl 3-(1H-indol-3-yl)-5-oxohexanoate
Property Insights of ethyl 3-(1H-indol-3-yl)-5-oxohexanoate
The XLogP value of 3.1838 indicates that ethyl 3-(1H-indol-3-yl)-5-oxohexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.16 Ų, ethyl 3-(1H-indol-3-yl)-5-oxohexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 3-(1H-indol-3-yl)-5-oxohexanoate has 1 hydrogen bond donor(s) and 3 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-(1H-indol-3-yl)-5-oxohexanoate?
The CAS number of ethyl 3-(1H-indol-3-yl)-5-oxohexanoate is 32897-74-8.
What is the molecular formula of ethyl 3-(1H-indol-3-yl)-5-oxohexanoate?
The molecular formula of ethyl 3-(1H-indol-3-yl)-5-oxohexanoate is C16H19NO3.
What is the molecular weight of ethyl 3-(1H-indol-3-yl)-5-oxohexanoate?
The molecular weight of ethyl 3-(1H-indol-3-yl)-5-oxohexanoate is 273.14 g/mol.
Where can I buy ethyl 3-(1H-indol-3-yl)-5-oxohexanoate?
You can request a quote for ethyl 3-(1H-indol-3-yl)-5-oxohexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(1H-indol-3-yl)-5-oxohexanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(1H-indol-3-yl)-5-oxohexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.