TL;DR: 2-((5-chlorobenzo[d]oxazol-2-yl)thio)-N,N-dimethylethanamine hydrochloride (CAS 1049725-02-1) is a chemical compound with molecular formula C11H14Cl2N2OS and molecular weight 292.0204 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-dimethylethanamine;hydrochloride
Also Known As: 2-((5-chlorobenzo[d]oxazol-2-yl)thio)-N,N-dimethylethanamine hydrochloride, 2-(5-chlorobenzooxazol-2-yl)sulfanyl-N,N-dimethyl-ethanamine Hydrochloride, 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-dimethylethanamine hydrochloride
| Molecular Formula | C11H14Cl2N2OS |
| Molecular Weight | 292.0204 g/mol |
| XLogP | 3.5567 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.0204 Da |
| Heavy Atoms | 17 |
| Complexity | 230.0 |
| SMILES | CN(C)CCSC1=NC2=C(O1)C=CC(=C2)Cl.Cl |
| InChIKey | ZPWDJAGWACTSEV-UHFFFAOYSA-N |
The XLogP value of 3.5567 indicates that 2-((5-chlorobenzo[d]oxazol-2-yl)thio)-N,N-dimethylethanamine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, 2-((5-chlorobenzo[d]oxazol-2-yl)thio)-N,N-dimethylethanamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((5-chlorobenzo[d]oxazol-2-yl)thio)-N,N-dimethylethanamine hydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-((5-chlorobenzo[d]oxazol-2-yl)thio)-N,N-dimethylethanamine hydrochloride is 1049725-02-1.
The molecular formula of 2-((5-chlorobenzo[d]oxazol-2-yl)thio)-N,N-dimethylethanamine hydrochloride is C11H14Cl2N2OS.
The molecular weight of 2-((5-chlorobenzo[d]oxazol-2-yl)thio)-N,N-dimethylethanamine hydrochloride is 292.0204 g/mol.
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