1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-
TL;DR: 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)- (CAS 154106-11-3) is a chemical compound with molecular formula C10H10ClN3O2S and molecular weight 271.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole
Also Known As: 4-Bromonicitinaldehyde, 3-(4-Chlorophenyl)-1-methyl-5-(methylsulfonyl)-1H-1,2,4-triazole, 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-, 3-(4-chlorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole, 1-Methyl-3-(4-chlorophenyl)-5-(methylsulfonyl)-1H-1,2,4-triazole
| Molecular Formula | C10H10ClN3O2S |
|---|---|
| Molecular Weight | 271.02 g/mol |
| LogP | 1.539 |
| Topological Polar Surface Area | 64.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.01822 |
| Heavy Atoms | 17 |
| Complexity | 646.69055 |
Chemical Identifiers
| CAS Number | 154106-11-3 |
|---|---|
| SMILES | CN1C(=NC(=N1)C2=CC=C(C=C2)Cl)S(=O)(=O)C |
Product Overview
1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)- (CAS 154106-11-3), with molecular formula C10H10ClN3O2S and molecular weight 271.02 g/mol. IUPAC: 3-(4-chlorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole.
Chemical Property Profile of 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-
Property Insights of 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-
The XLogP value of 1.539 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-. The TPSA of 64.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)- has 0 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 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-?
The CAS number of 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)- is 154106-11-3.
What is the molecular formula of 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-?
The molecular formula of 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)- is C10H10ClN3O2S.
What is the molecular weight of 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-?
The molecular weight of 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)- is 271.02 g/mol.
Where can I buy 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-?
You can request a quote for 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole, 3-(4-chlorophenyl)-1-methyl-5-(methylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.