![4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione structure](/static/products/3117/311781-39-2.webp)
4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione
TL;DR: 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione (CAS 311781-39-2) is a chemical compound with molecular formula C16H14N4OS and molecular weight 310.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione
Also Known As: BIM-0026343.P001, A1461/0064387, 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione, (E)-4-((3-methoxybenzylidene)amino)-5-phenyl-4H-1,2,4-triazole-3-thiol, 4-((3-METHOXYBENZYLIDENE)AMINO)-5-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL
| Molecular Formula | C16H14N4OS |
|---|---|
| Molecular Weight | 310.09 g/mol |
| LogP | 3.49849 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.08884 |
| Heavy Atoms | 22 |
| Complexity | 851.8373 |
Chemical Identifiers
| CAS Number | 311781-39-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)/C=N/N2C(=NNC2=S)C3=CC=CC=C3 |
Product Overview
4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione (CAS 311781-39-2), with molecular formula C16H14N4OS and molecular weight 310.09 g/mol. IUPAC: 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione
Property Insights of 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione
The XLogP value of 3.49849 indicates that 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione has 1 hydrogen bond donor(s) and 4 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 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione?
The CAS number of 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione is 311781-39-2.
What is the molecular formula of 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione?
The molecular formula of 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione is C16H14N4OS.
What is the molecular weight of 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione?
The molecular weight of 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione is 310.09 g/mol.
Where can I buy 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione?
You can request a quote for 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-[(E)-(3-methoxyphenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.