delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-
TL;DR: delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- (CAS 27349-24-2) is a chemical compound with molecular formula C9H8ClN3S and molecular weight 225.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-2-methyl-1H-1,2,4-triazole-3-thione
Also Known As: 5-26-04-00334 (Beilstein Handbook Reference), delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-, 3-(4-chlorophenyl)-1-methyl-1H-1,2,4-triazole-5-thiol, 3-(p-Chlorophenyl)-1-methyldelta(sup 2)-1,2,4-triazoline-5-thione, AE-842/33003032
| Molecular Formula | C9H8ClN3S |
|---|---|
| Molecular Weight | 225.01 g/mol |
| LogP | 2.79809 |
| Topological Polar Surface Area | 33.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.01274 |
| Heavy Atoms | 14 |
| Complexity | 497.52078 |
Chemical Identifiers
| CAS Number | 27349-24-2 |
|---|---|
| SMILES | CN1C(=S)N=C(N1)C2=CC=C(C=C2)Cl |
Product Overview
delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- (CAS 27349-24-2), with molecular formula C9H8ClN3S and molecular weight 225.01 g/mol. IUPAC: 5-(4-chlorophenyl)-2-methyl-1H-1,2,4-triazole-3-thione.
Chemical Property Profile of delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-
Property Insights of delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-
The XLogP value of 2.79809 suggests moderate lipophilicity, balancing water solubility and membrane permeability for delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-. With a topological polar surface area (TPSA) of 33.61 Ų, delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- has 1 hydrogen bond donor(s) and 2 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 delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-?
The CAS number of delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- is 27349-24-2.
What is the molecular formula of delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-?
The molecular formula of delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- is C9H8ClN3S.
What is the molecular weight of delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-?
The molecular weight of delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- is 225.01 g/mol.
Where can I buy delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-?
You can request a quote for delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl-?
Yes, KEHONG BIO provides custom synthesis services for delta(sup 2)-1,2,4-Triazoline-5-thione, 3-(p-chlorophenyl)-1-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.