TL;DR: RefChem:368830 (CAS 16793-51-4) is a chemical compound with molecular formula C15H24Cl3NO and molecular weight 339.09235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-chloroethyl)-2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-N-methylethanamine;hydrochloride
Also Known As: WV 0010, Phenetole, 4-chloro-beta-(N-(2-chloroethyl)-N-methylamino)-2-isopropyl-5-methyl-, hydrochloride, 4-Chloro-beta-(N-(2-chloroethyl)-N-methylamino)-2-isopropyl-5-methylphenetole hydrochloride, p-Cymene, 2-chloro-5-(2-(N-(2-chloroethyl)-N-methylamino)ethoxy)-, hydrochloride, Diethylamine, 2-chloro-2'-[(6-chlorothymyl)oxy]-N-methyl-, hydrochloride
| Molecular Formula | C15H24Cl3NO |
| Molecular Weight | 339.09235 g/mol |
| XLogP | 4.74302 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 339.09235 Da |
| Heavy Atoms | 20 |
| Complexity | 250.0 |
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OCCN(C)CCCl.Cl |
| InChIKey | KOELOQAHVZOIRM-UHFFFAOYSA-N |
The XLogP value of 4.74302 indicates that RefChem:368830 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, RefChem:368830 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:368830 has 1 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 RefChem:368830 is 16793-51-4.
The molecular formula of RefChem:368830 is C15H24Cl3NO.
The molecular weight of RefChem:368830 is 339.09235 g/mol.
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