RefChem:824090
TL;DR: RefChem:824090 (CAS 587005-19-4) is a chemical compound with molecular formula C19H21N5OS and molecular weight 367.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: N-(2,5-dimethylphenyl)-2-{[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2,5-Dimethylphenyl)-2-((4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2,5-DIMETHYLPHENYL)-2-{[4-ETHYL-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE, N-(2,5-dimethylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(2,5-dimethylphenyl)-2-(4-ethyl-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))acetam ide
| Molecular Formula | C19H21N5OS |
|---|---|
| Molecular Weight | 367.15 g/mol |
| LogP | 3.70764 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.14667 |
| Heavy Atoms | 26 |
| Complexity | 907.54785 |
Chemical Identifiers
| CAS Number | 587005-19-4 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C)C)C3=CN=CC=C3 |
Product Overview
RefChem:824090 (CAS 587005-19-4), with molecular formula C19H21N5OS and molecular weight 367.15 g/mol. IUPAC: N-(2,5-dimethylphenyl)-2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of RefChem:824090
Property Insights of RefChem:824090
The XLogP value of 3.70764 indicates that RefChem:824090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:824090. Following Lipinski's Rule of Five, RefChem:824090 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 RefChem:824090?
The CAS number of RefChem:824090 is 587005-19-4.
What is the molecular formula of RefChem:824090?
The molecular formula of RefChem:824090 is C19H21N5OS.
What is the molecular weight of RefChem:824090?
The molecular weight of RefChem:824090 is 367.15 g/mol.
Where can I buy RefChem:824090?
You can request a quote for RefChem:824090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:824090?
Yes, KEHONG BIO provides custom synthesis services for RefChem:824090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.