5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
TL;DR: 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 488707-13-7) is a chemical compound with molecular formula C19H15N3OS and molecular weight 333.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione
Also Known As: AN-919/40843069, A3034/0128015, 3-(4-methoxyphenyl)-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione, 3-(4-methoxyphenyl)-4-(naphthalen-1-yl)-1H-1,2,4-triazole-5(4H)-thione, 5-(4-methoxyphenyl)-4-(1-naphthyl)-4H-1,2,4-triazol-3-yl hydrosulfide
| Molecular Formula | C19H15N3OS |
|---|---|
| Molecular Weight | 333.09 g/mol |
| LogP | 4.75869 |
| Topological Polar Surface Area | 42.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.0936 |
| Heavy Atoms | 24 |
| Complexity | 1058.6171 |
Chemical Identifiers
| CAS Number | 488707-13-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NNC(=S)N2C3=CC=CC4=CC=CC=C43 |
Product Overview
5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 488707-13-7), with molecular formula C19H15N3OS and molecular weight 333.09 g/mol. IUPAC: 3-(4-methoxyphenyl)-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Property Insights of 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
The XLogP value of 4.75869 indicates that 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.84 Ų, 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione 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 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The CAS number of 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is 488707-13-7.
What is the molecular formula of 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular formula of 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is C19H15N3OS.
What is the molecular weight of 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular weight of 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is 333.09 g/mol.
Where can I buy 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
You can request a quote for 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-methoxyphenyl)-4-(naphthalen-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.