TL;DR: 5-(Chloromethyl)-2-phenyl-1,3-thiazole (CAS 110704-38-6) is a chemical compound with molecular formula C10H8ClNS and molecular weight 209.00659 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(chloromethyl)-2-phenyl-1,3-thiazole
Also Known As: 5-(chloromethyl)-2-phenyl-1,3-thiazole, 5-(Chloromethyl)-2-phenylthiazole, 5-Chloromethyl-2-phenyl-thiazole, Oxazole,2-(chloromethyl)-4-phenyl, 5-(Chloromethyl)-2-phenyl-1,3-thiazole hydrochloride
| Molecular Formula | C10H8ClNS |
| Molecular Weight | 209.00659 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.00659 Da |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
| SMILES | C1=CC=C(C=C1)C2=NC=C(S2)CCl |
| InChIKey | JIOYGVBKFKVRAZ-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 5-(Chloromethyl)-2-phenyl-1,3-thiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 5-(Chloromethyl)-2-phenyl-1,3-thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Chloromethyl)-2-phenyl-1,3-thiazole 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 5-(Chloromethyl)-2-phenyl-1,3-thiazole is 110704-38-6.
The molecular formula of 5-(Chloromethyl)-2-phenyl-1,3-thiazole is C10H8ClNS.
The molecular weight of 5-(Chloromethyl)-2-phenyl-1,3-thiazole is 209.00659 g/mol.
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