2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide
TL;DR: 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide (CAS 618441-38-6) is a chemical compound with molecular formula C16H23N5OS and molecular weight 333.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-N-propylacetamide
Also Known As: SALOR-INT L443530-1EA, 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-yl)thio)-N-phenyl-N-propylacetamide, 2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-N-propyl-acetamide, 2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-N-propylacetamide, 644-763-3
| Molecular Formula | C16H23N5OS |
|---|---|
| Molecular Weight | 333.16 g/mol |
| LogP | 2.6506 |
| Topological Polar Surface Area | 77.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 333.16232 |
| Heavy Atoms | 23 |
| Complexity | 641.1751 |
Chemical Identifiers
| CAS Number | 618441-38-6 |
|---|---|
| SMILES | CCCN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2N)C(C)C |
Product Overview
2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide (CAS 618441-38-6), with molecular formula C16H23N5OS and molecular weight 333.16 g/mol. IUPAC: 2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-N-propylacetamide.
Chemical Property Profile of 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide
Property Insights of 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide
The XLogP value of 2.6506 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide. The TPSA of 77.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide. Following Lipinski's Rule of Five, 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide has 1 hydrogen bond donor(s) and 5 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-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide?
The CAS number of 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide is 618441-38-6.
What is the molecular formula of 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide?
The molecular formula of 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide is C16H23N5OS.
What is the molecular weight of 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide?
The molecular weight of 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide is 333.16 g/mol.
Where can I buy 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide?
You can request a quote for 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide 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-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Amino-5-isopropyl-4H-1,2,4-triazol-3-YL)thio)-N-phenyl-N-propylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.