TL;DR: 4-(Sec-butyl)-2-chlorothiazole (CAS 1341922-88-0) is a chemical compound with molecular formula C7H10ClNS and molecular weight 175.02225 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-butan-2-yl-2-chloro-1,3-thiazole
Also Known As: 4-(sec-butyl)-2-chlorothiazole, 4-(butan-2-yl)-2-chloro-1,3-thiazole, 4-butan-2-yl-2-chloro-1,3-thiazole, 2-chloro-4-(sec-butyl)-1,3-thiazole, G51704
| Molecular Formula | C7H10ClNS |
| Molecular Weight | 175.02225 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.02225 Da |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
| SMILES | CCC(C)C1=CSC(=N1)Cl |
| InChIKey | QWMHSHJZVJIHKV-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 4-(Sec-butyl)-2-chlorothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 4-(Sec-butyl)-2-chlorothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Sec-butyl)-2-chlorothiazole 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 4-(Sec-butyl)-2-chlorothiazole is 1341922-88-0.
The molecular formula of 4-(Sec-butyl)-2-chlorothiazole is C7H10ClNS.
The molecular weight of 4-(Sec-butyl)-2-chlorothiazole is 175.02225 g/mol.
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