RefChem:825331
TL;DR: RefChem:825331 (CAS 587012-06-4) is a chemical compound with molecular formula C19H22N6OS and molecular weight 382.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethyl-6-methylphenyl)-2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: 2-((4-Ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-ethyl-6-methylphenyl)acetamide, N-(2-ETHYL-6-METHYLPHENYL)-2-{[4-ETHYL-5-(2-PYRAZINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE, N-(6-ethyl-2-methylphenyl)-2-(4-ethyl-5-pyrazin-2-yl(1,2,4-triazol-3-ylthio))a cetamide, 2-{[4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethyl-6-methylphenyl)acetamide, 643-895-9
| Molecular Formula | C19H22N6OS |
|---|---|
| Molecular Weight | 382.16 g/mol |
| LogP | 3.35662 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 382.1576 |
| Heavy Atoms | 27 |
| Complexity | 925.2042 |
Chemical Identifiers
| CAS Number | 587012-06-4 |
|---|---|
| SMILES | CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC)C3=NC=CN=C3)C |
Product Overview
RefChem:825331 (CAS 587012-06-4), with molecular formula C19H22N6OS and molecular weight 382.16 g/mol. IUPAC: N-(2-ethyl-6-methylphenyl)-2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of RefChem:825331
Property Insights of RefChem:825331
The XLogP value of 3.35662 indicates that RefChem:825331 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.59 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:825331. Following Lipinski's Rule of Five, RefChem:825331 has 1 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 RefChem:825331?
The CAS number of RefChem:825331 is 587012-06-4.
What is the molecular formula of RefChem:825331?
The molecular formula of RefChem:825331 is C19H22N6OS.
What is the molecular weight of RefChem:825331?
The molecular weight of RefChem:825331 is 382.16 g/mol.
Where can I buy RefChem:825331?
You can request a quote for RefChem:825331 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:825331?
Yes, KEHONG BIO provides custom synthesis services for RefChem:825331 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.