Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide
TL;DR: Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide (CAS 676246-75-6) is a chemical compound with molecular formula C17H16N4S and molecular weight 308.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-methyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine
Also Known As: SALOR-INT L409154-1EA, 4-(5-(Cinnamylthio)-4-methyl-4H-1,2,4-triazol-3-yl)pyridine, 4-[4-methyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine, 4-{4-methyl-5-[(3-phenyl-2-propen-1-yl)thio]-4H-1,2,4-triazol-3-yl}pyridine, cinnamyl 4-methyl-5-(4-pyridinyl)-4h-1,2,4-triazol-3-yl sulfide
| Molecular Formula | C17H16N4S |
|---|---|
| Molecular Weight | 308.11 g/mol |
| LogP | 3.6826 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.10956 |
| Heavy Atoms | 22 |
| Complexity | 750.84485 |
Chemical Identifiers
| CAS Number | 676246-75-6 |
|---|---|
| SMILES | CN1C(=NN=C1SC/C=C/C2=CC=CC=C2)C3=CC=NC=C3 |
Product Overview
Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide (CAS 676246-75-6), with molecular formula C17H16N4S and molecular weight 308.11 g/mol. IUPAC: 4-[4-methyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine.
Chemical Property Profile of Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide
Property Insights of Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide
The XLogP value of 3.6826 indicates that Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide has 0 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 Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide?
The CAS number of Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide is 676246-75-6.
What is the molecular formula of Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide?
The molecular formula of Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide is C17H16N4S.
What is the molecular weight of Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide?
The molecular weight of Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide is 308.11 g/mol.
Where can I buy Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide?
You can request a quote for Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide?
Yes, KEHONG BIO provides custom synthesis services for Cinnamyl 4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.