TL;DR: 4-(4-hydroxyphenyl)phthalazin-1(2H)-one (CAS 152594-70-2) is a chemical compound with molecular formula C14H10N2O2 and molecular weight 238.07423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-hydroxyphenyl)-2H-phthalazin-1-one
Also Known As: 4-(4-hydroxyphenyl)phthalazin-1(2H)-one, 4-(4-hydroxyphenyl)-1,2-dihydrophthalazin-1-one, 4-(4-Hydroxyphenyl)phthalazin-1-ol, 4-(4-hydroxyphenyl)-1(2H)-phthalazinone, 1(2H)-Phthalazinone, 4-(4-hydroxyphenyl)-
| Molecular Formula | C14H10N2O2 |
| Molecular Weight | 238.07423 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 61.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.07423 Da |
| Heavy Atoms | 18 |
| Complexity | 359.0 |
| SMILES | C1=CC=C2C(=C1)C(=NNC2=O)C3=CC=C(C=C3)O |
| InChIKey | LYLHOKOTRWUGIF-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-hydroxyphenyl)phthalazin-1(2H)-one. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-hydroxyphenyl)phthalazin-1(2H)-one. Following Lipinski's Rule of Five, 4-(4-hydroxyphenyl)phthalazin-1(2H)-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(4-hydroxyphenyl)phthalazin-1(2H)-one is 152594-70-2.
The molecular formula of 4-(4-hydroxyphenyl)phthalazin-1(2H)-one is C14H10N2O2.
The molecular weight of 4-(4-hydroxyphenyl)phthalazin-1(2H)-one is 238.07423 g/mol.
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