![2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione structure](/static/products/727/72731-44-3.png)
2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione
TL;DR: 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione (CAS 72731-44-3) is a chemical compound with molecular formula C8H15N3S and molecular weight 185.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1,2,4-triazaspiro[4.5]decane-3-thione
Also Known As: 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione, 3-methyl-1,3,4-triazaspiro[4.5]decane-2-thione, AB01325981-02, 1,2,4-Triazaspiro[4,5]decane-3-thione, 2-methyl-, 2-methyl-1,2,4-triazaspiro[4.5]dec-3-ene-3-thiol
| Molecular Formula | C8H15N3S |
|---|---|
| Molecular Weight | 185.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 185.09866 |
| Heavy Atoms | 12 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 72731-44-3 |
|---|---|
| SMILES | CN1C(=S)NC2(N1)CCCCC2 |
| InChIKey | UCTFTVQRMRIXOB-UHFFFAOYSA-N |
Product Overview
2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione (CAS 72731-44-3), with molecular formula C8H15N3S and molecular weight 185.10 g/mol. IUPAC: 2-methyl-1,2,4-triazaspiro[4.5]decane-3-thione.
Chemical Property Profile of 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione
Property Insights of 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione. With a topological polar surface area (TPSA) of 59.4 Ų, 2-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-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-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The CAS number of 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione is 72731-44-3.
What is the molecular formula of 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The molecular formula of 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione is C8H15N3S.
What is the molecular weight of 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The molecular weight of 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione is 185.10 g/mol.
Where can I buy 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
You can request a quote for 2-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-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1,2,4-triazaspiro[4.5]decane-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.