2-oxo-2-phenylethyl 1H-indol-3-ylacetate
TL;DR: 2-oxo-2-phenylethyl 1H-indol-3-ylacetate (CAS 797812-94-3) is a chemical compound with molecular formula C18H15NO3 and molecular weight 293.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl 2-(1H-indol-3-yl)acetate
Also Known As: phenacyl 2-(1H-indol-3-yl)acetate, BAS 04395151, 2-oxo-2-phenylethyl 1H-indol-3-ylacetate, (1H-Indol-3-yl)-acetic acid 2-oxo-2-phenyl-ethyl ester, BRD-K09488190-001-07-8
| Molecular Formula | C18H15NO3 |
|---|---|
| Molecular Weight | 293.11 g/mol |
| LogP | 3.1365 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.1052 |
| Heavy Atoms | 22 |
| Complexity | 805.325 |
Chemical Identifiers
| CAS Number | 797812-94-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)COC(=O)CC2=CNC3=CC=CC=C32 |
Product Overview
2-oxo-2-phenylethyl 1H-indol-3-ylacetate (CAS 797812-94-3), with molecular formula C18H15NO3 and molecular weight 293.11 g/mol. IUPAC: phenacyl 2-(1H-indol-3-yl)acetate.
Chemical Property Profile of 2-oxo-2-phenylethyl 1H-indol-3-ylacetate
Property Insights of 2-oxo-2-phenylethyl 1H-indol-3-ylacetate
The XLogP value of 3.1365 indicates that 2-oxo-2-phenylethyl 1H-indol-3-ylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.16 Ų, 2-oxo-2-phenylethyl 1H-indol-3-ylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-oxo-2-phenylethyl 1H-indol-3-ylacetate 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 2-oxo-2-phenylethyl 1H-indol-3-ylacetate?
The CAS number of 2-oxo-2-phenylethyl 1H-indol-3-ylacetate is 797812-94-3.
What is the molecular formula of 2-oxo-2-phenylethyl 1H-indol-3-ylacetate?
The molecular formula of 2-oxo-2-phenylethyl 1H-indol-3-ylacetate is C18H15NO3.
What is the molecular weight of 2-oxo-2-phenylethyl 1H-indol-3-ylacetate?
The molecular weight of 2-oxo-2-phenylethyl 1H-indol-3-ylacetate is 293.11 g/mol.
Where can I buy 2-oxo-2-phenylethyl 1H-indol-3-ylacetate?
You can request a quote for 2-oxo-2-phenylethyl 1H-indol-3-ylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxo-2-phenylethyl 1H-indol-3-ylacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-2-phenylethyl 1H-indol-3-ylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.