3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile
TL;DR: 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile (CAS 17380-27-7) is a chemical compound with molecular formula C17H14N2O and molecular weight 262.11063 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1-hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile
Also Known As: 1-((5-Cyano)-3-indolyl)-2-phenyl ethanol, 1-Ethanol, 1-(5-cyano-3-indolyl)-2-phenyl-, 3-(alpha-Hydroxyphenethyl)indole-5-carbonitrile, 3-(1-hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile, INDOLE-5-CARBONITRILE, 3-(alpha-HYDROXYPHENETHYL)-
Technical Specifications
| Molecular Formula | C17H14N2O |
| Molecular Weight | 262.11063 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 59.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.11063 Da |
| Heavy Atoms | 20 |
| Complexity | 368.0 |
| SMILES | C1=CC=C(C=C1)CC(C2=CNC3=C2C=C(C=C3)C#N)O |
| InChIKey | FYFJYVULGPVOJY-UHFFFAOYSA-N |
Chemical Property Profile of 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile
Property Insights of 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile. With a topological polar surface area (TPSA) of 59.8 Ų, 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile has 2 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 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile?
The CAS number of 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile is 17380-27-7.
What is the molecular formula of 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile?
The molecular formula of 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile is C17H14N2O.
What is the molecular weight of 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile?
The molecular weight of 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile is 262.11063 g/mol.
Where can I buy 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile?
You can request a quote for 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 3-(1-Hydroxy-2-phenylethyl)-1H-indole-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.