3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine
TL;DR: 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine (CAS 876713-81-4) is a chemical compound with molecular formula C19H17N5O2S2 and molecular weight 411.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)sulfonyl-5-pyridin-3-yl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine
Also Known As: BAS 10422654, 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine, 2-(4-methylphenyl)sulfonyl-5-pyridin-3-yl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine, 1-(4-METHYLBENZENESULFONYL)-3-(PYRIDIN-3-YL)-N-[(THIOPHEN-2-YL)METHYL]-1H-1,2,4-TRIAZOL-5-AMINE, 1-[(4-methylphenyl)sulfonyl]-3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5-amine
| Molecular Formula | C19H17N5O2S2 |
|---|---|
| Molecular Weight | 411.08 g/mol |
| LogP | 3.55912 |
| Topological Polar Surface Area | 89.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.08237 |
| Heavy Atoms | 28 |
| Complexity | 1169.0641 |
Chemical Identifiers
| CAS Number | 876713-81-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=CS4 |
Product Overview
3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine (CAS 876713-81-4), with molecular formula C19H17N5O2S2 and molecular weight 411.08 g/mol. IUPAC: 2-(4-methylphenyl)sulfonyl-5-pyridin-3-yl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine.
Chemical Property Profile of 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine
Property Insights of 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine
The XLogP value of 3.55912 indicates that 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine. Following Lipinski's Rule of Five, 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine has 1 hydrogen bond donor(s) and 7 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-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine?
The CAS number of 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine is 876713-81-4.
What is the molecular formula of 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine?
The molecular formula of 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine is C19H17N5O2S2.
What is the molecular weight of 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine?
The molecular weight of 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine is 411.08 g/mol.
Where can I buy 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine?
You can request a quote for 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(pyridin-3-yl)-N-(thiophen-2-ylmethyl)-1-tosyl-1H-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.