![4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride structure](/static/products/557/55746-21-9.png)
4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride
TL;DR: 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride (CAS 55746-21-9) is a chemical compound with molecular formula C8H15ClN4S and molecular weight 234.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-methylsulfanyl-5-pyrrolidin-2-yl-1,2,4-triazole;hydrochloride
Also Known As: C-Chroman-6-yl-methylamine, N-xanthen-9-yl-succinamic acid, 4-METHYL-3-METHYLSULFANYL-5-PYRROLIDIN-2-YL-4H-[1,2,4]TRIAZOLE HYDROCHLORIDE, 4-Methyl-3-(methylthio)-5-(pyrrolidin-2-yl)-4H-1,2,4-triazole hydrochloride, 4-methyl-3-methylsulfanyl-5-pyrrolidin-2-yl-1,2,4-triazole;hydrochloride
| Molecular Formula | C8H15ClN4S |
|---|---|
| Molecular Weight | 234.07 g/mol |
| LogP | 1.3833 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0706 |
| Heavy Atoms | 14 |
| Complexity | 295.53143 |
Chemical Identifiers
| CAS Number | 55746-21-9 |
|---|---|
| SMILES | CN1C(=NN=C1SC)C2CCCN2.Cl |
Product Overview
4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride (CAS 55746-21-9), with molecular formula C8H15ClN4S and molecular weight 234.07 g/mol. IUPAC: 4-methyl-3-methylsulfanyl-5-pyrrolidin-2-yl-1,2,4-triazole;hydrochloride.
Chemical Property Profile of 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride
Property Insights of 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride
The XLogP value of 1.3833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride. With a topological polar surface area (TPSA) of 42.74 Ų, 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride has 1 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 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride?
The CAS number of 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride is 55746-21-9.
What is the molecular formula of 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride?
The molecular formula of 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride is C8H15ClN4S.
What is the molecular weight of 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride?
The molecular weight of 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride is 234.07 g/mol.
Where can I buy 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride?
You can request a quote for 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-3-methylsulfanyl-5-pyrrolidin-2-YL-4H-[1,2,4]triazole hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.