![4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione structure](/static/products/3117/311799-24-3.webp)
4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione
TL;DR: 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione (CAS 311799-24-3) is a chemical compound with molecular formula C16H22N4S and molecular weight 302.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione
Also Known As: 4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione, A1711/0072939, 4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione, 4-methyl-2-[(4-methyl-1-piperidinyl)methyl]-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione, 4-methyl-1-((4-methylpiperidin-1-yl)methyl)-3-phenyl-1H-1,2,4-triazole-5(4H)-thione
| Molecular Formula | C16H22N4S |
|---|---|
| Molecular Weight | 302.16 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 54.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.15652 |
| Heavy Atoms | 21 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 311799-24-3 |
|---|---|
| SMILES | CC1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C |
| InChIKey | RLDQXWDVHSMUQJ-UHFFFAOYSA-N |
Product Overview
4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione (CAS 311799-24-3), with molecular formula C16H22N4S and molecular weight 302.16 g/mol. IUPAC: 4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione.
Chemical Property Profile of 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione
Property Insights of 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione
The XLogP value of 3.2 indicates that 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.2 Ų, 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione has 0 hydrogen bond donor(s) and 3 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-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione?
The CAS number of 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione is 311799-24-3.
What is the molecular formula of 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione?
The molecular formula of 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione is C16H22N4S.
What is the molecular weight of 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione?
The molecular weight of 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione is 302.16 g/mol.
Where can I buy 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione?
You can request a quote for 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-phenyl-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.