ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate
TL;DR: ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate (CAS 380315-40-2) is a chemical compound with molecular formula C20H19NO3 and molecular weight 321.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1-benzyl-3-formylindol-2-yl)acetate
Also Known As: ethyl 2-(1-benzyl-3-formylindol-2-yl)acetate, ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate, ethyl 2-(1-benzyl-3-formyl-1H-indol-2-yl)acetate
| Molecular Formula | C20H19NO3 |
|---|---|
| Molecular Weight | 321.14 g/mol |
| LogP | 3.6077 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.1365 |
| Heavy Atoms | 24 |
| Complexity | 865.22626 |
Chemical Identifiers
| CAS Number | 380315-40-2 |
|---|---|
| SMILES | CCOC(=O)CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)C=O |
Product Overview
ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate (CAS 380315-40-2), with molecular formula C20H19NO3 and molecular weight 321.14 g/mol. IUPAC: ethyl 2-(1-benzyl-3-formylindol-2-yl)acetate.
Chemical Property Profile of ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate
Property Insights of ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate
The XLogP value of 3.6077 indicates that ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.3 Ų, ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate has 0 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 (1-benzyl-3-formyl-1H-indol-2-yl)acetate?
The CAS number of ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate is 380315-40-2.
What is the molecular formula of ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate?
The molecular formula of ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate is C20H19NO3.
What is the molecular weight of ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate?
The molecular weight of ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate is 321.14 g/mol.
Where can I buy ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate?
You can request a quote for ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (1-benzyl-3-formyl-1H-indol-2-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.