Indole-5-carbonitrile, 3-(phenylacetyl)-
TL;DR: Indole-5-carbonitrile, 3-(phenylacetyl)- (CAS 17380-23-3) is a chemical compound with molecular formula C17H12N2O and molecular weight 260.09497 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-phenylacetyl)-1H-indole-5-carbonitrile
Also Known As: 5-Cyano-3-(phenylacetyl) indole, 3-(Phenylacetyl)indole-5-carbonitrile, INDOLE-5-CARBONITRILE, 3-(PHENYLACETYL)-, 3-(Phenylacetyl)-1H-indole-5-carbonitrile, 3-(2-phenylacetyl)-1H-indole-5-carbonitrile
Technical Specifications
| Molecular Formula | C17H12N2O |
| Molecular Weight | 260.09497 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.09497 Da |
| Heavy Atoms | 20 |
| Complexity | 404.0 |
| SMILES | C1=CC=C(C=C1)CC(=O)C2=CNC3=C2C=C(C=C3)C#N |
| InChIKey | CQBGCMKFYSUZPJ-UHFFFAOYSA-N |
Chemical Property Profile of Indole-5-carbonitrile, 3-(phenylacetyl)-
Property Insights of Indole-5-carbonitrile, 3-(phenylacetyl)-
The XLogP value of 3.0 indicates that Indole-5-carbonitrile, 3-(phenylacetyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.7 Ų, Indole-5-carbonitrile, 3-(phenylacetyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole-5-carbonitrile, 3-(phenylacetyl)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Indole-5-carbonitrile, 3-(phenylacetyl)-?
The CAS number of Indole-5-carbonitrile, 3-(phenylacetyl)- is 17380-23-3.
What is the molecular formula of Indole-5-carbonitrile, 3-(phenylacetyl)-?
The molecular formula of Indole-5-carbonitrile, 3-(phenylacetyl)- is C17H12N2O.
What is the molecular weight of Indole-5-carbonitrile, 3-(phenylacetyl)-?
The molecular weight of Indole-5-carbonitrile, 3-(phenylacetyl)- is 260.09497 g/mol.
Where can I buy Indole-5-carbonitrile, 3-(phenylacetyl)-?
You can request a quote for Indole-5-carbonitrile, 3-(phenylacetyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Indole-5-carbonitrile, 3-(phenylacetyl)-?
Yes, CoreyChem provides custom synthesis services for Indole-5-carbonitrile, 3-(phenylacetyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.