1H-Indole, 2-(phenylthio)-
TL;DR: 1H-Indole, 2-(phenylthio)- (CAS 120517-31-9) is a chemical compound with molecular formula C14H11NS and molecular weight 225.06122 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenylsulfanyl-1H-indole
Also Known As: 1H-Indole, 2-(phenylthio)-, 2-phenylthioindole, 2-phenylsulfanyl-1H-indole, 2-phenylthio-1H-indole, 1H-indol-2-yl phenyl sulfide
Technical Specifications
| Molecular Formula | C14H11NS |
| Molecular Weight | 225.06122 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.06122 Da |
| Heavy Atoms | 16 |
| Complexity | 225.0 |
| SMILES | C1=CC=C(C=C1)SC2=CC3=CC=CC=C3N2 |
| InChIKey | FWYRWEJVTFYFPK-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Indole, 2-(phenylthio)-
Property Insights of 1H-Indole, 2-(phenylthio)-
The XLogP value of 4.5 indicates that 1H-Indole, 2-(phenylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 1H-Indole, 2-(phenylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole, 2-(phenylthio)- 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
What is the CAS number of 1H-Indole, 2-(phenylthio)-?
The CAS number of 1H-Indole, 2-(phenylthio)- is 120517-31-9.
What is the molecular formula of 1H-Indole, 2-(phenylthio)-?
The molecular formula of 1H-Indole, 2-(phenylthio)- is C14H11NS.
What is the molecular weight of 1H-Indole, 2-(phenylthio)-?
The molecular weight of 1H-Indole, 2-(phenylthio)- is 225.06122 g/mol.
Where can I buy 1H-Indole, 2-(phenylthio)-?
You can request a quote for 1H-Indole, 2-(phenylthio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Indole, 2-(phenylthio)-?
Yes, CoreyChem provides custom synthesis services for 1H-Indole, 2-(phenylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.