2-Butyl-4,5-dimethylthiazole
TL;DR: 2-Butyl-4,5-dimethylthiazole (CAS 76572-48-0) is a chemical compound with molecular formula C9H15NS and molecular weight 169.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-4,5-dimethyl-1,3-thiazole
Also Known As: 2-BUTYL-4,5-DIMETHYLTHIAZOLE, 2-Butyl-4,5-dimethyl-1,3-thiazole, 2-butyl-4,5-dimethyl thiazole, Thiazole, 2-butyl-4,5-dimethyl-, 2-Butyl-4,5-dimethyl-thiazole
| Molecular Formula | C9H15NS |
|---|---|
| Molecular Weight | 169.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 169.09251 |
| Heavy Atoms | 11 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 76572-48-0 |
|---|---|
| SMILES | CCCCC1=NC(=C(S1)C)C |
| InChIKey | OHJFDYDPHXVQBC-UHFFFAOYSA-N |
Product Overview
2-Butyl-4,5-dimethylthiazole (CAS 76572-48-0), with molecular formula C9H15NS and molecular weight 169.09 g/mol. IUPAC: 2-butyl-4,5-dimethyl-1,3-thiazole.
Chemical Property Profile of 2-Butyl-4,5-dimethylthiazole
Property Insights of 2-Butyl-4,5-dimethylthiazole
The XLogP value of 3.5 indicates that 2-Butyl-4,5-dimethylthiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 2-Butyl-4,5-dimethylthiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butyl-4,5-dimethylthiazole 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 2-Butyl-4,5-dimethylthiazole?
The CAS number of 2-Butyl-4,5-dimethylthiazole is 76572-48-0.
What is the molecular formula of 2-Butyl-4,5-dimethylthiazole?
The molecular formula of 2-Butyl-4,5-dimethylthiazole is C9H15NS.
What is the molecular weight of 2-Butyl-4,5-dimethylthiazole?
The molecular weight of 2-Butyl-4,5-dimethylthiazole is 169.09 g/mol.
Where can I buy 2-Butyl-4,5-dimethylthiazole?
You can request a quote for 2-Butyl-4,5-dimethylthiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butyl-4,5-dimethylthiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Butyl-4,5-dimethylthiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.