TL;DR: 1,1-Bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol (CAS 122135-78-8) is a chemical compound with molecular formula C24H26O4 and molecular weight 378.1831 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol
Also Known As: 1,1-Bis(4-ethoxyphenyl)-2-phenyl-1,2-ethanediol, 1,2-Ethanediol, 1,1-bis(4-ethoxyphenyl)-2-phenyl-, 1,1-bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol, BRN 3627404
| Molecular Formula | C24H26O4 |
| Molecular Weight | 378.1831 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 378.1831 Da |
| Heavy Atoms | 28 |
| Complexity | 406.0 |
| SMILES | CCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)(C(C3=CC=CC=C3)O)O |
| InChIKey | YHKCLASAUBDJQT-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that 1,1-Bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, 1,1-Bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol 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 1,1-Bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol is 122135-78-8.
The molecular formula of 1,1-Bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol is C24H26O4.
The molecular weight of 1,1-Bis(4-ethoxyphenyl)-2-phenylethane-1,2-diol is 378.1831 g/mol.
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