2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide
TL;DR: 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide (CAS 348592-05-2) is a chemical compound with molecular formula C17H20ClN5OS and molecular weight 377.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclohexylideneamino)acetamide
Also Known As: 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide, 2-[[5-(3-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclohexylideneamino)acetamide, 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-cyclohexylideneacetohydrazide
| Molecular Formula | C17H20ClN5OS |
|---|---|
| Molecular Weight | 377.11 g/mol |
| LogP | 3.6639 |
| Topological Polar Surface Area | 72.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.1077 |
| Heavy Atoms | 25 |
| Complexity | 781.09546 |
Chemical Identifiers
| CAS Number | 348592-05-2 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NN=C2CCCCC2)C3=CC(=CC=C3)Cl |
Product Overview
2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide (CAS 348592-05-2), with molecular formula C17H20ClN5OS and molecular weight 377.11 g/mol. IUPAC: 2-[[5-(3-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclohexylideneamino)acetamide.
Chemical Property Profile of 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide
Property Insights of 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide
The XLogP value of 3.6639 indicates that 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide. Following Lipinski's Rule of Five, 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide 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-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide?
The CAS number of 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide is 348592-05-2.
What is the molecular formula of 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide?
The molecular formula of 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide is C17H20ClN5OS.
What is the molecular weight of 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide?
The molecular weight of 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide is 377.11 g/mol.
Where can I buy 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide?
You can request a quote for 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-((5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-cyclohexylideneacetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.