TL;DR: RefChem:338904 (CAS 102107-30-2) is a chemical compound with molecular formula C23H34ClNO3 and molecular weight 407.22272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis[2-(2-methoxyphenyl)propyl]-methylazanium;ethenol;chloride
Also Known As: U-7236, Diphenethylamine, o,o'-dimethoxy-N,alpha,alpha'-trimethyl-, hydrochloride, vinyl alcohol, bis[2-(2-methoxyphenyl)propyl]-methylazanium; ethenol; chloride, Diphenylethylamine, o,o'-dimethoxy-N,alpha,alpha'-trimethyl-, hydrochloride, ethenolate, o,o'-Dimethoxy-N,alpha,alpha'-trimethyl-diphenethylamine, hydrochloride vinyl alcohol
| Molecular Formula | C23H34ClNO3 |
| Molecular Weight | 407.22272 g/mol |
| XLogP | 0.82 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 407.22272 Da |
| Heavy Atoms | 28 |
| Complexity | 327.0 |
| SMILES | CC(C[NH+](C)CC(C)C1=CC=CC=C1OC)C2=CC=CC=C2OC.C=CO.[Cl-] |
| InChIKey | MIYLCYSFOYUGGS-UHFFFAOYSA-N |
The XLogP value of 0.82 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:338904. With a topological polar surface area (TPSA) of 43.1 Ų, RefChem:338904 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:338904 has 2 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 RefChem:338904 is 102107-30-2.
The molecular formula of RefChem:338904 is C23H34ClNO3.
The molecular weight of RefChem:338904 is 407.22272 g/mol.
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