4-(2-Pyridinylmethyl)-1(2H)-phthalazinone
TL;DR: 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone (CAS 107559-06-8) is a chemical compound with molecular formula C14H11N3O and molecular weight 237.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(pyridin-2-ylmethyl)-2H-phthalazin-1-one
Also Known As: 4-(2-pyridinylmethyl)-1(2H)-phthalazinone, 4-(pyridin-2-ylmethyl)phthalazin-1(2H)-one, SDCCGMLS-0064412.P001, 4-(pyridin-2-ylmethyl)phthalazin-1-ol, 4-(pyridin-2-ylmethyl)-2H-phthalazin-1-one
| Molecular Formula | C14H11N3O |
|---|---|
| Molecular Weight | 237.09 g/mol |
| LogP | 1.9089 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.09021 |
| Heavy Atoms | 18 |
| Complexity | 734.61523 |
Chemical Identifiers
| CAS Number | 107559-06-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NNC2=O)CC3=CC=CC=N3 |
Product Overview
4-(2-Pyridinylmethyl)-1(2H)-phthalazinone (CAS 107559-06-8), with molecular formula C14H11N3O and molecular weight 237.09 g/mol. IUPAC: 4-(pyridin-2-ylmethyl)-2H-phthalazin-1-one.
Chemical Property Profile of 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone
Property Insights of 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone
The XLogP value of 1.9089 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone. With a topological polar surface area (TPSA) of 58.64 Ų, 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone?
The CAS number of 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone is 107559-06-8.
What is the molecular formula of 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone?
The molecular formula of 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone is C14H11N3O.
What is the molecular weight of 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone?
The molecular weight of 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone is 237.09 g/mol.
Where can I buy 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone?
You can request a quote for 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Pyridinylmethyl)-1(2H)-phthalazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.