![2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone structure](/static/products/1008/1008582-73-7.webp)
2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone
TL;DR: 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone (CAS 1008582-73-7) is a chemical compound with molecular formula C23H25ClN4O2S and molecular weight 456.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-(2-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone
Also Known As: 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone, 2-[[5-(4-chlorophenyl)-4-(2-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone
| Molecular Formula | C23H25ClN4O2S |
|---|---|
| Molecular Weight | 456.14 g/mol |
| LogP | 4.662 |
| Topological Polar Surface Area | 60.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.13867 |
| Heavy Atoms | 31 |
| Complexity | 1045.985 |
Chemical Identifiers
| CAS Number | 1008582-73-7 |
|---|---|
| SMILES | CC(C)C1=CC=CC=C1N2C(=NN=C2SCC(=O)N3CCOCC3)C4=CC=C(C=C4)Cl |
Product Overview
2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone (CAS 1008582-73-7), with molecular formula C23H25ClN4O2S and molecular weight 456.14 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-(2-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone.
Chemical Property Profile of 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone
Property Insights of 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone
The XLogP value of 4.662 indicates that 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone. Following Lipinski's Rule of Five, 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone has 0 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-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone?
The CAS number of 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone is 1008582-73-7.
What is the molecular formula of 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone?
The molecular formula of 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone is C23H25ClN4O2S.
What is the molecular weight of 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone?
The molecular weight of 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone is 456.14 g/mol.
Where can I buy 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone?
You can request a quote for 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[[5-(4-Chlorophenyl)-4-[2-(1-methylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.