TL;DR: 2-Bromo-4-butylthiazole (CAS 1027276-19-2) is a chemical compound with molecular formula C7H10BrNS and molecular weight 218.97173 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-4-butyl-1,3-thiazole
Also Known As: 2-Bromo-4-butylthiazole, 2-bromo-4-butyl-1,3-thiazole
| Molecular Formula | C7H10BrNS |
| Molecular Weight | 218.97173 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.97173 Da |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
| SMILES | CCCCC1=CSC(=N1)Br |
| InChIKey | TXZVFOYPYVUWGP-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 2-Bromo-4-butylthiazole 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-Bromo-4-butylthiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-4-butylthiazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Bromo-4-butylthiazole is 1027276-19-2.
The molecular formula of 2-Bromo-4-butylthiazole is C7H10BrNS.
The molecular weight of 2-Bromo-4-butylthiazole is 218.97173 g/mol.
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