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2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione
TL;DR: 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione (CAS 301227-55-4) is a chemical compound with molecular formula C18H12N2O2 and molecular weight 288.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione
Also Known As: 2-(pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione, 2-(pyridin-3-ylmethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione, 2-Pyridin-3-ylmethyl-benzo[de]isoquinoline-1,3-dione, 2-(3-pyridinylmethyl)benzo[de]isoquinoline-1,3-dione, 2-(3-pyridylmethyl)benzo[de]isoquinoline-1,3-quinone
| Molecular Formula | C18H12N2O2 |
|---|---|
| Molecular Weight | 288.09 g/mol |
| LogP | 3.031 |
| Topological Polar Surface Area | 50.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.08987 |
| Heavy Atoms | 22 |
| Complexity | 852.614 |
Chemical Identifiers
| CAS Number | 301227-55-4 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CC4=CN=CC=C4 |
Product Overview
2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione (CAS 301227-55-4), with molecular formula C18H12N2O2 and molecular weight 288.09 g/mol. IUPAC: 2-(pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione
Property Insights of 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione
The XLogP value of 3.031 indicates that 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.27 Ų, 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione has 0 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 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione?
The CAS number of 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione is 301227-55-4.
What is the molecular formula of 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione?
The molecular formula of 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione is C18H12N2O2.
What is the molecular weight of 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione?
The molecular weight of 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione is 288.09 g/mol.
Where can I buy 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione?
You can request a quote for 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(Pyridin-3-ylmethyl)benzo[de]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.