(S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride
TL;DR: (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride (CAS 1052518-89-4) is a chemical compound with molecular formula C16H19ClN4OS and molecular weight 350.0968 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S)-2-(1H-indol-3-yl)-1-[5-(2-methylprop-2-enylsulfanyl)-1,3,4-oxadiazol-2-yl]ethanamine;hydrochloride
Also Known As: (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride, (1S)-2-(1H-indol-3-yl)-1-[5-(2-methylprop-2-enylsulfanyl)-1,3,4-oxadiazol-2-yl]ethanamine hydrochloride
Technical Specifications
| Molecular Formula | C16H19ClN4OS |
| Molecular Weight | 350.0968 g/mol |
| XLogP | 3.8834 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.0968 Da |
| Heavy Atoms | 23 |
| Complexity | 394.0 |
| SMILES | CC(=C)CSC1=NN=C(O1)[C@H](CC2=CNC3=CC=CC=C32)N.Cl |
| InChIKey | PKOCGLVDLCWWAU-ZOWNYOTGSA-N |
Chemical Property Profile of (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride
Property Insights of (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride
The XLogP value of 3.8834 indicates that (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride. Following Lipinski's Rule of Five, (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride?
The CAS number of (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride is 1052518-89-4.
What is the molecular formula of (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride?
The molecular formula of (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride is C16H19ClN4OS.
What is the molecular weight of (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride?
The molecular weight of (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride is 350.0968 g/mol.
Where can I buy (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride?
You can request a quote for (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride?
Yes, CoreyChem provides custom synthesis services for (S)-2-(1H-indol-3-yl)-1-(5-((2-methylallyl)thio)-1,3,4-oxadiazol-2-yl)ethanamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.