2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide
TL;DR: 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide (CAS 577990-13-7) is a chemical compound with molecular formula C16H15ClN6OS and molecular weight 374.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-chloro-2-methylphenyl)acetamide
Also Known As: Salor-int l465844-1ea, 2-((4-Amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-chloro-2-methylphenyl)acetamide, 2-{[4-amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chloro-2-methylphenyl)acetamide, 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide, 2-(4-amino-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))-N-(4-chloro-2-methylphenyl)a cetamide
| Molecular Formula | C16H15ClN6OS |
|---|---|
| Molecular Weight | 374.07 g/mol |
| LogP | 2.74652 |
| Topological Polar Surface Area | 98.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.07166 |
| Heavy Atoms | 25 |
| Complexity | 898.8955 |
Chemical Identifiers
| CAS Number | 577990-13-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)NC(=O)CSC2=NN=C(N2N)C3=CN=CC=C3 |
Product Overview
2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide (CAS 577990-13-7), with molecular formula C16H15ClN6OS and molecular weight 374.07 g/mol. IUPAC: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-chloro-2-methylphenyl)acetamide.
Chemical Property Profile of 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide
Property Insights of 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide
The XLogP value of 2.74652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide. The TPSA of 98.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide. Following Lipinski's Rule of Five, 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide has 2 hydrogen bond donor(s) and 6 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 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide?
The CAS number of 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide is 577990-13-7.
What is the molecular formula of 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide?
The molecular formula of 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide is C16H15ClN6OS.
What is the molecular weight of 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide?
The molecular weight of 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide is 374.07 g/mol.
Where can I buy 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide?
You can request a quote for 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)N-(4-CL-2-ME-PH)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.