![6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione structure](/static/products/312/312499-86-8.png)
6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione
TL;DR: 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione (CAS 312499-86-8) is a chemical compound with molecular formula C14H19N3S and molecular weight 261.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione
Also Known As: ChemDiv1_027514, 6-methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione, 6-methyl-3-phenyl-1,3,4-triazaspiro[4.5]decane-2-thione, A1895/0079530, 10-methyl-3-phenyl-1,3,4-triazaspiro[4.5]decane-2-thione
| Molecular Formula | C14H19N3S |
|---|---|
| Molecular Weight | 261.13 g/mol |
| LogP | 2.7921 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.12997 |
| Heavy Atoms | 18 |
| Complexity | 447.61215 |
Chemical Identifiers
| CAS Number | 312499-86-8 |
|---|---|
| SMILES | CC1CCCCC12NC(=S)N(N2)C3=CC=CC=C3 |
Product Overview
6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione (CAS 312499-86-8), with molecular formula C14H19N3S and molecular weight 261.13 g/mol. IUPAC: 6-methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione.
Chemical Property Profile of 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione
Property Insights of 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione
The XLogP value of 2.7921 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione. With a topological polar surface area (TPSA) of 27.3 Ų, 6-Methyl-2-phenyl-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, 6-Methyl-2-phenyl-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 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The CAS number of 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione is 312499-86-8.
What is the molecular formula of 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The molecular formula of 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione is C14H19N3S.
What is the molecular weight of 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione?
The molecular weight of 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione is 261.13 g/mol.
Where can I buy 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione?
You can request a quote for 6-Methyl-2-phenyl-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 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.