![2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide structure](/static/products/850/850349-65-4.png)
2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide
TL;DR: 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide (CAS 850349-65-4) is a chemical compound with molecular formula C16H20N4OS and molecular weight 316.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-ylacetamide
Also Known As: 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide, 2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-ylacetamide, 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-yl)acetamide
| Molecular Formula | C16H20N4OS |
|---|---|
| Molecular Weight | 316.14 g/mol |
| LogP | 2.7614 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.13577 |
| Heavy Atoms | 22 |
| Complexity | 649.42035 |
Chemical Identifiers
| CAS Number | 850349-65-4 |
|---|---|
| SMILES | CC(C)NC(=O)CSC1=NN(C(=N1)C2CC2)C3=CC=CC=C3 |
Product Overview
2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide (CAS 850349-65-4), with molecular formula C16H20N4OS and molecular weight 316.14 g/mol. IUPAC: 2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-ylacetamide.
Chemical Property Profile of 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide
Property Insights of 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide
The XLogP value of 2.7614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide. With a topological polar surface area (TPSA) of 59.81 Ų, 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide has 1 hydrogen bond donor(s) and 4 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-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide?
The CAS number of 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide is 850349-65-4.
What is the molecular formula of 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide?
The molecular formula of 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide is C16H20N4OS.
What is the molecular weight of 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide?
The molecular weight of 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide is 316.14 g/mol.
Where can I buy 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide?
You can request a quote for 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-Cyclopropyl-1-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.