2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide
TL;DR: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide (CAS 6651-64-5) is a chemical compound with molecular formula C22H25N5O4S and molecular weight 455.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide
Also Known As: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide, 2-[(4-Ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(2,3,4-trimethoxyphenyl)methylidene]acetohydrazide
| Molecular Formula | C22H25N5O4S |
|---|---|
| Molecular Weight | 455.16 g/mol |
| LogP | 3.2332 |
| Topological Polar Surface Area | 99.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 455.16272 |
| Heavy Atoms | 32 |
| Complexity | 1085.4253 |
Chemical Identifiers
| CAS Number | 6651-64-5 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NN=CC2=C(C(=C(C=C2)OC)OC)OC)C3=CC=CC=C3 |
Product Overview
2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide (CAS 6651-64-5), with molecular formula C22H25N5O4S and molecular weight 455.16 g/mol. IUPAC: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide.
Chemical Property Profile of 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide
Property Insights of 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide
The XLogP value of 3.2332 indicates that 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide. Following Lipinski's Rule of Five, 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide has 1 hydrogen bond donor(s) and 8 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-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide?
The CAS number of 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide is 6651-64-5.
What is the molecular formula of 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide?
The molecular formula of 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide is C22H25N5O4S.
What is the molecular weight of 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide?
The molecular weight of 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide is 455.16 g/mol.
Where can I buy 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide?
You can request a quote for 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]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-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2,3,4-trimethoxyphenyl)methylideneamino]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.