1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-
TL;DR: 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- (CAS 110960-77-5) is a chemical compound with molecular formula C10H9N3S and molecular weight 203.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethenylsulfanyl-5-phenyl-1H-1,2,4-triazole
Also Known As: 3-Vinylthio-5-phenyl-1,2,4-triazole, 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-, 3-(Ethenylthio)-5-phenyl-1H-1,2,4-triazole, 3-ethenylsulfanyl-5-phenyl-1H-1,2,4-triazole, 5-phenyl-3-(vinylthio)-1,2,4-triazole
| Molecular Formula | C10H9N3S |
|---|---|
| Molecular Weight | 203.05 g/mol |
| LogP | 2.7073 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.05171 |
| Heavy Atoms | 14 |
| Complexity | 421.942 |
Chemical Identifiers
| CAS Number | 110960-77-5 |
|---|---|
| SMILES | C=CSC1=NNC(=N1)C2=CC=CC=C2 |
Product Overview
1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- (CAS 110960-77-5), with molecular formula C10H9N3S and molecular weight 203.05 g/mol. IUPAC: 3-ethenylsulfanyl-5-phenyl-1H-1,2,4-triazole.
Chemical Property Profile of 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-
Property Insights of 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-
The XLogP value of 2.7073 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-. With a topological polar surface area (TPSA) of 41.57 Ų, 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-?
The CAS number of 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- is 110960-77-5.
What is the molecular formula of 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-?
The molecular formula of 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- is C10H9N3S.
What is the molecular weight of 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-?
The molecular weight of 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- is 203.05 g/mol.
Where can I buy 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-?
You can request a quote for 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole, 3-(ethenylthio)-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.