4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide
TL;DR: 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide (CAS 496787-39-4) is a chemical compound with molecular formula C17H12N4S and molecular weight 304.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-naphthalen-1-yl-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione
Also Known As: BAS 06803688, 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide, 4-naphthalen-1-yl-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione, AN-919/40843085, 4-(naphthalen-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
| Molecular Formula | C17H12N4S |
|---|---|
| Molecular Weight | 304.08 g/mol |
| LogP | 4.14509 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 304.07828 |
| Heavy Atoms | 22 |
| Complexity | 996.5357 |
Chemical Identifiers
| CAS Number | 496787-39-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2N3C(=NNC3=S)C4=CN=CC=C4 |
Product Overview
4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide (CAS 496787-39-4), with molecular formula C17H12N4S and molecular weight 304.08 g/mol. IUPAC: 4-naphthalen-1-yl-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Property Insights of 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide
The XLogP value of 4.14509 indicates that 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide 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 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide?
The CAS number of 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide is 496787-39-4.
What is the molecular formula of 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide?
The molecular formula of 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide is C17H12N4S.
What is the molecular weight of 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide?
The molecular weight of 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide is 304.08 g/mol.
Where can I buy 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide?
You can request a quote for 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide?
Yes, KEHONG BIO provides custom synthesis services for 4-(1-naphthyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.