4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one
TL;DR: 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one (CAS 154810-22-7) is a chemical compound with molecular formula C14H14N2O and molecular weight 226.11061 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-phenyl-5,6,7,8-tetrahydro-2H-phthalazin-1-one
Also Known As: 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one, 4-phenyl-5,6,7,8-tetrahydro-2H-phthalazin-1-one, 1(2H)-Phthalazinone, 5,6,7,8-tetrahydro-4-phenyl-, 1(2H)-Phthalazinone,5,6,7,8-tetrahydro-4-phenyl, 4-phenyl-1,2,5,6,7,8-hexahydrophthalazin-1-one
Technical Specifications
| Molecular Formula | C14H14N2O |
| Molecular Weight | 226.11061 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.11061 Da |
| Heavy Atoms | 17 |
| Complexity | 389.0 |
| SMILES | C1CCC2=C(C1)C(=NNC2=O)C3=CC=CC=C3 |
| InChIKey | HGXKVNRBKJMVLX-UHFFFAOYSA-N |
Chemical Property Profile of 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Property Insights of 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one. With a topological polar surface area (TPSA) of 41.5 Ų, 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one?
The CAS number of 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one is 154810-22-7.
What is the molecular formula of 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one?
The molecular formula of 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one is C14H14N2O.
What is the molecular weight of 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one?
The molecular weight of 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one is 226.11061 g/mol.
Where can I buy 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one?
You can request a quote for 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one?
Yes, CoreyChem provides custom synthesis services for 4-phenyl-5,6,7,8-tetrahydrophthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.