1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-
TL;DR: 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- (CAS 59395-24-3) is a chemical compound with molecular formula C10H12ClN3S and molecular weight 241.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenyl)-5,5-dimethyl-1,2,4-triazolidine-3-thione
Also Known As: 2-(3-Chlorophenyl)-5,5-dimethyl-1,2,4-triazolidine-3-thione, 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-, 1-(3-Chlorophenyl)-3,3-dimethyl-1,2,4-triazolidin-5-thion, 1-(3-Chlorophenyl)-3,3-dimethyl-1,2,4-triazolidin-5-thion [German], RefChem:215075
| Molecular Formula | C10H12ClN3S |
|---|---|
| Molecular Weight | 241.04 g/mol |
| LogP | 2.2752 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.04405 |
| Heavy Atoms | 15 |
| Complexity | 405.4089 |
Chemical Identifiers
| CAS Number | 59395-24-3 |
|---|---|
| SMILES | CC1(NC(=S)N(N1)C2=CC(=CC=C2)Cl)C |
Product Overview
1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- (CAS 59395-24-3), with molecular formula C10H12ClN3S and molecular weight 241.04 g/mol. IUPAC: 2-(3-chlorophenyl)-5,5-dimethyl-1,2,4-triazolidine-3-thione.
Chemical Property Profile of 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-
Property Insights of 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-
The XLogP value of 2.2752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-. With a topological polar surface area (TPSA) of 27.3 Ų, 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- has 2 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 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-?
The CAS number of 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- is 59395-24-3.
What is the molecular formula of 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-?
The molecular formula of 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- is C10H12ClN3S.
What is the molecular weight of 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-?
The molecular weight of 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- is 241.04 g/mol.
Where can I buy 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-?
You can request a quote for 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Triazolidine-3-thione, 2-(3-chlorophenyl)-5,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.