2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide
TL;DR: 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide (CAS 577980-67-7) 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.
2-[[4-amino-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(dimethylamino)phenyl]acetamide
Also Known As: 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide, 2-[[4-amino-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-dimethylaminophenyl)acetamide
| Molecular Formula | C19H22N6OS |
|---|---|
| Molecular Weight | 382.16 g/mol |
| LogP | 2.76412 |
| Topological Polar Surface Area | 89.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.1576 |
| Heavy Atoms | 27 |
| Complexity | 935.62787 |
Chemical Identifiers
| CAS Number | 577980-67-7 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NN=C(N2N)SCC(=O)NC3=CC=C(C=C3)N(C)C |
Product Overview
2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide (CAS 577980-67-7), with molecular formula C19H22N6OS and molecular weight 382.16 g/mol. IUPAC: 2-[[4-amino-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(dimethylamino)phenyl]acetamide.
Chemical Property Profile of 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide
Property Insights of 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide
The XLogP value of 2.76412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide. The TPSA of 89.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide. Following Lipinski's Rule of Five, 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide has 2 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 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide?
The CAS number of 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide is 577980-67-7.
What is the molecular formula of 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide?
The molecular formula of 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide is C19H22N6OS.
What is the molecular weight of 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide?
The molecular weight of 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide is 382.16 g/mol.
Where can I buy 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide?
You can request a quote for 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)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-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-amino-5-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(dimethylamino)phenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.