RefChem:449153
TL;DR: RefChem:449153 (CAS 333331-32-1) is a chemical compound with molecular formula C18H19N5O2S and molecular weight 369.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Also Known As: BAS 02241103, 2-{[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide, 2-{[4-ethyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide, 2-((4-Ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-methoxyphenyl)acetamide, 2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
| Molecular Formula | C18H19N5O2S |
|---|---|
| Molecular Weight | 369.13 g/mol |
| LogP | 3.0994 |
| Topological Polar Surface Area | 81.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 369.12595 |
| Heavy Atoms | 26 |
| Complexity | 882.2978 |
Chemical Identifiers
| CAS Number | 333331-32-1 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2OC)C3=CN=CC=C3 |
Product Overview
RefChem:449153 (CAS 333331-32-1), with molecular formula C18H19N5O2S and molecular weight 369.13 g/mol. IUPAC: 2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide.
Chemical Property Profile of RefChem:449153
Property Insights of RefChem:449153
The XLogP value of 3.0994 indicates that RefChem:449153 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.93 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:449153. Following Lipinski's Rule of Five, RefChem:449153 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:449153?
The CAS number of RefChem:449153 is 333331-32-1.
What is the molecular formula of RefChem:449153?
The molecular formula of RefChem:449153 is C18H19N5O2S.
What is the molecular weight of RefChem:449153?
The molecular weight of RefChem:449153 is 369.13 g/mol.
Where can I buy RefChem:449153?
You can request a quote for RefChem:449153 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:449153?
Yes, KEHONG BIO provides custom synthesis services for RefChem:449153 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.