![1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one structure](/static/products/714/714938-32-6.webp)
1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one
TL;DR: 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one (CAS 714938-32-6) is a chemical compound with molecular formula C24H20ClN3O4S and molecular weight 481.0863 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone
Also Known As: 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one, 2-((5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-1-(3,4-dihydroxyphenyl)ethanone, 2-[[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone, 2-{[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethan-1-one, 2-{[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethanone
Technical Specifications
| Molecular Formula | C24H20ClN3O4S |
| Molecular Weight | 481.0863 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 481.0863 Da |
| Heavy Atoms | 33 |
| Complexity | 631.0 |
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC(=C(C=C3)O)O)C4=CC=C(C=C4)Cl |
| InChIKey | JYNJCMHZLRSSBA-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one
Property Insights of 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one
The XLogP value of 5.3 indicates that 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one. Following Lipinski's Rule of Five, 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one?
The CAS number of 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one is 714938-32-6.
What is the molecular formula of 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one?
The molecular formula of 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one is C24H20ClN3O4S.
What is the molecular weight of 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one?
The molecular weight of 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one is 481.0863 g/mol.
Where can I buy 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one?
You can request a quote for 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.