2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide
TL;DR: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide (CAS 854349-45-4) is a chemical compound with molecular formula C15H16N6O4S3 and molecular weight 440.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide
Also Known As: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide, 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoyl-phenyl)acetamide, 2-{[4-amino-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxy-3-sulfamoylphenyl)acetamide
| Molecular Formula | C15H16N6O4S3 |
|---|---|
| Molecular Weight | 440.04 g/mol |
| LogP | 1.1072 |
| Topological Polar Surface Area | 155.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 440.03952 |
| Heavy Atoms | 28 |
| Complexity | 1095.1866 |
Chemical Identifiers
| CAS Number | 854349-45-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC=CS3)S(=O)(=O)N |
Product Overview
2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide (CAS 854349-45-4), with molecular formula C15H16N6O4S3 and molecular weight 440.04 g/mol. IUPAC: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide.
Chemical Property Profile of 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide
Property Insights of 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide
The XLogP value of 1.1072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide. The TPSA of 155.22 Ų indicates high polarity, suggesting 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide has 3 hydrogen bond donor(s) and 9 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-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
The CAS number of 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide is 854349-45-4.
What is the molecular formula of 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
The molecular formula of 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide is C15H16N6O4S3.
What is the molecular weight of 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
The molecular weight of 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide is 440.04 g/mol.
Where can I buy 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
You can request a quote for 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)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-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-3-sulfamoylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.