1-(1H-Indol-3-yl)-2-phenylethanone
TL;DR: 1-(1H-Indol-3-yl)-2-phenylethanone (CAS 40496-58-0) is a chemical compound with molecular formula C16H13NO and molecular weight 235.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-indol-3-yl)-2-phenylethanone
Also Known As: 1-(1H-Indol-3-yl)-2-phenylethanone, 3-Phenylacetylindol, 3-phenylacetylindole, 1-(1H-INDOL-3-YL)-2-PHENYL-ETHANONE, 1-(1H-indol-3-yl)-2-phenylethan-1-one
| Molecular Formula | C16H13NO |
|---|---|
| Molecular Weight | 235.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 32.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.09972 |
| Heavy Atoms | 18 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 40496-58-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)C2=CNC3=CC=CC=C32 |
| InChIKey | MVJGJYRFWKGPTI-UHFFFAOYSA-N |
Product Overview
1-(1H-Indol-3-yl)-2-phenylethanone (CAS 40496-58-0), with molecular formula C16H13NO and molecular weight 235.10 g/mol. IUPAC: 1-(1H-indol-3-yl)-2-phenylethanone.
Chemical Property Profile of 1-(1H-Indol-3-yl)-2-phenylethanone
Property Insights of 1-(1H-Indol-3-yl)-2-phenylethanone
The XLogP value of 3.7 indicates that 1-(1H-Indol-3-yl)-2-phenylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.9 Ų, 1-(1H-Indol-3-yl)-2-phenylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1H-Indol-3-yl)-2-phenylethanone has 1 hydrogen bond donor(s) and 1 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 1-(1H-Indol-3-yl)-2-phenylethanone?
The CAS number of 1-(1H-Indol-3-yl)-2-phenylethanone is 40496-58-0.
What is the molecular formula of 1-(1H-Indol-3-yl)-2-phenylethanone?
The molecular formula of 1-(1H-Indol-3-yl)-2-phenylethanone is C16H13NO.
What is the molecular weight of 1-(1H-Indol-3-yl)-2-phenylethanone?
The molecular weight of 1-(1H-Indol-3-yl)-2-phenylethanone is 235.10 g/mol.
Where can I buy 1-(1H-Indol-3-yl)-2-phenylethanone?
You can request a quote for 1-(1H-Indol-3-yl)-2-phenylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-Indol-3-yl)-2-phenylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-Indol-3-yl)-2-phenylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.