![2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione structure](/static/products/488/488122-16-3.png)
2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione
TL;DR: 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione (CAS 488122-16-3) is a chemical compound with molecular formula C16H23N3S and molecular weight 289.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione
Also Known As: 2-(3,4-dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione, 3-(3,4-dimethylphenyl)-8-methyl-1,3,4-triazaspiro[4.5]decane-2-thione
| Molecular Formula | C16H23N3S |
|---|---|
| Molecular Weight | 289.16 g/mol |
| LogP | 3.40894 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 289.16125 |
| Heavy Atoms | 20 |
| Complexity | 532.52356 |
Chemical Identifiers
| CAS Number | 488122-16-3 |
|---|---|
| SMILES | CC1CCC2(CC1)NC(=S)N(N2)C3=CC(=C(C=C3)C)C |
Product Overview
2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione (CAS 488122-16-3), with molecular formula C16H23N3S and molecular weight 289.16 g/mol. IUPAC: 2-(3,4-dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione.
Chemical Property Profile of 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione
Property Insights of 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione
The XLogP value of 3.40894 indicates that 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.3 Ų, 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione 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 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The CAS number of 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione is 488122-16-3.
What is the molecular formula of 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The molecular formula of 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione is C16H23N3S.
What is the molecular weight of 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The molecular weight of 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione is 289.16 g/mol.
Where can I buy 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
You can request a quote for 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethylphenyl)-8-methyl-1,2,4-triazaspiro[4.5]decane-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.