4-Tert-butyl-3-methyl-1,3-thiazole-2-thione
TL;DR: 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione (CAS 17294-29-0) is a chemical compound with molecular formula C8H13NS2 and molecular weight 187.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-3-methyl-1,3-thiazole-2-thione
Also Known As: 4-tert-butyl-3-methyl-1,3-thiazole-2-thione, 4-tert-butyl-3-methyl-1,3-thiazole-2(3H)-thione, AB-601/30963062
| Molecular Formula | C8H13NS2 |
|---|---|
| Molecular Weight | 187.05 g/mol |
| LogP | 3.11359 |
| Topological Polar Surface Area | 4.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 187.04893 |
| Heavy Atoms | 11 |
| Complexity | 300.62735 |
Chemical Identifiers
| CAS Number | 17294-29-0 |
|---|---|
| SMILES | CC(C)(C)C1=CSC(=S)N1C |
Product Overview
4-Tert-butyl-3-methyl-1,3-thiazole-2-thione (CAS 17294-29-0), with molecular formula C8H13NS2 and molecular weight 187.05 g/mol. IUPAC: 4-tert-butyl-3-methyl-1,3-thiazole-2-thione.
Chemical Property Profile of 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione
Property Insights of 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione
The XLogP value of 3.11359 indicates that 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.93 Ų, 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione has 0 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 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione?
The CAS number of 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione is 17294-29-0.
What is the molecular formula of 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione?
The molecular formula of 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione is C8H13NS2.
What is the molecular weight of 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione?
The molecular weight of 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione is 187.05 g/mol.
Where can I buy 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione?
You can request a quote for 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butyl-3-methyl-1,3-thiazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.