1-Phenyl-3-(2-(phenylthio)ethyl)thiourea
TL;DR: 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea (CAS 13084-43-0) is a chemical compound with molecular formula C15H16N2S2 and molecular weight 288.0755 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-phenyl-3-(2-phenylsulfanylethyl)thiourea
Also Known As: 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea, 1-phenyl-3-(2-phenylsulfanylethyl)thiourea, 1-phenyl-3-[2-(phenylsulfanyl)ethyl]thiourea, 1-Phenyl-3-(2-(phenylthio)ethyl)-thiourea, 1-Phenyl-3-[2-(phenylthio)ethyl]thiourea
Technical Specifications
| Molecular Formula | C15H16N2S2 |
| Molecular Weight | 288.0755 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 81.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.0755 Da |
| Heavy Atoms | 19 |
| Complexity | 259.0 |
| SMILES | C1=CC=C(C=C1)NC(=S)NCCSC2=CC=CC=C2 |
| InChIKey | NGMWSIDKFLFFBD-UHFFFAOYSA-N |
Chemical Property Profile of 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea
Property Insights of 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea
The XLogP value of 3.3 indicates that 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea. Following Lipinski's Rule of Five, 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea 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 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea?
The CAS number of 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea is 13084-43-0.
What is the molecular formula of 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea?
The molecular formula of 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea is C15H16N2S2.
What is the molecular weight of 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea?
The molecular weight of 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea is 288.0755 g/mol.
Where can I buy 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea?
You can request a quote for 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea?
Yes, CoreyChem provides custom synthesis services for 1-Phenyl-3-(2-(phenylthio)ethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.