TL;DR: 1,5-Diphenyl-1,4-pentadiyn-3-OL (CAS 15814-32-1) is a chemical compound with molecular formula C17H12O and molecular weight 232.08882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,5-diphenylpenta-1,4-diyn-3-ol
Also Known As: 1,5-Diphenyl-1,4-pentadiyn-3-ol, Di(phenylethynyl)methanol, 1,5-diphenylpenta-1,4-diyn-3-ol, 1,4-Pentadiyn-3-ol, 1,5-diphenyl-, 1,5-Diphenyl-1,4-pentadiyne-3-ol
| Molecular Formula | C17H12O |
| Molecular Weight | 232.08882 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.08882 Da |
| Heavy Atoms | 18 |
| Complexity | 333.0 |
| SMILES | C1=CC=C(C=C1)C#CC(C#CC2=CC=CC=C2)O |
| InChIKey | ZEECGOMCOVMMME-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 1,5-Diphenyl-1,4-pentadiyn-3-OL is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 1,5-Diphenyl-1,4-pentadiyn-3-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Diphenyl-1,4-pentadiyn-3-OL has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,5-Diphenyl-1,4-pentadiyn-3-OL is 15814-32-1.
The molecular formula of 1,5-Diphenyl-1,4-pentadiyn-3-OL is C17H12O.
The molecular weight of 1,5-Diphenyl-1,4-pentadiyn-3-OL is 232.08882 g/mol.
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