![8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione structure](/static/products/3097/309741-07-9.webp)
8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
TL;DR: 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione (CAS 309741-07-9) is a chemical compound with molecular formula C17H24ClN3S and molecular weight 337.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-tert-butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
Also Known As: ChemDiv1_026220, 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione, A2286/0096257, 1,2,4-Triazaspiro[4.5]decane-3-thione, 8-tert-butyl-2-(4-chlorophenyl)-, 8-(tert-butyl)-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
| Molecular Formula | C17H24ClN3S |
|---|---|
| Molecular Weight | 337.14 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.13794 |
| Heavy Atoms | 22 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 309741-07-9 |
|---|---|
| SMILES | CC(C)(C)C1CCC2(CC1)NC(=S)N(N2)C3=CC=C(C=C3)Cl |
| InChIKey | IKDKOKKETBHSNN-UHFFFAOYSA-N |
Product Overview
8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione (CAS 309741-07-9), with molecular formula C17H24ClN3S and molecular weight 337.14 g/mol. IUPAC: 8-tert-butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione.
Chemical Property Profile of 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
Property Insights of 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
The XLogP value of 5.0 indicates that 8-tert-Butyl-2-(4-chlorophenyl)-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 59.4 Ų, 8-tert-Butyl-2-(4-chlorophenyl)-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, 8-tert-Butyl-2-(4-chlorophenyl)-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 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione?
The CAS number of 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione is 309741-07-9.
What is the molecular formula of 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione?
The molecular formula of 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione is C17H24ClN3S.
What is the molecular weight of 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione?
The molecular weight of 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione is 337.14 g/mol.
Where can I buy 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione?
You can request a quote for 8-tert-Butyl-2-(4-chlorophenyl)-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 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 8-tert-Butyl-2-(4-chlorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.