3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine
TL;DR: 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine (CAS 1164526-48-0) is a chemical compound with molecular formula C16H15N5S and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-3-phenylprop-2-enyl]sulfanyl-5-pyridin-3-yl-1,2,4-triazol-4-amine
Also Known As: 3-(CINNAMYLTHIO)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-4-AMINE, 3-(Cinnamylthio)-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine, 3-((2E)-3-phenylprop-2-enylthio)-5-(3-pyridyl)-1,2,4-triazole-4-ylamine, 3-[(E)-3-phenylprop-2-enyl]sulfanyl-5-pyridin-3-yl-1,2,4-triazol-4-amine, 3-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine
| Molecular Formula | C16H15N5S |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 2.8594 |
| Topological Polar Surface Area | 69.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.10483 |
| Heavy Atoms | 22 |
| Complexity | 752.72205 |
Chemical Identifiers
| CAS Number | 1164526-48-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/CSC2=NN=C(N2N)C3=CN=CC=C3 |
Product Overview
3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine (CAS 1164526-48-0), with molecular formula C16H15N5S and molecular weight 309.10 g/mol. IUPAC: 3-[(E)-3-phenylprop-2-enyl]sulfanyl-5-pyridin-3-yl-1,2,4-triazol-4-amine.
Chemical Property Profile of 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine
Property Insights of 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine
The XLogP value of 2.8594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine. The TPSA of 69.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine. Following Lipinski's Rule of Five, 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine has 1 hydrogen bond donor(s) and 5 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 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine?
The CAS number of 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine is 1164526-48-0.
What is the molecular formula of 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine?
The molecular formula of 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine is C16H15N5S.
What is the molecular weight of 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine?
The molecular weight of 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine is 309.10 g/mol.
Where can I buy 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine?
You can request a quote for 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Cinnamylthio)-5-(3-pyridinyl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.