5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione
TL;DR: 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione (CAS 162265-47-6) is a chemical compound with molecular formula C19H13N3O4 and molecular weight 347.0906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-nitro-2-(2-pyridin-2-ylethyl)benzo[de]isoquinoline-1,3-dione
Also Known As: Maybridge1_005628, DivK1c_001916, CDS1_000876, 1H-Benz(de)isoquinoline-1,3(2H)-dione, 5-nitro-2-(2-(2-pyridinyl)ethyl)-, 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione
Technical Specifications
| Molecular Formula | C19H13N3O4 |
| Molecular Weight | 347.0906 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 96.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.0906 Da |
| Heavy Atoms | 26 |
| Complexity | 590.0 |
| SMILES | C1=CC=NC(=C1)CCN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-] |
| InChIKey | MRGCRNYNMDQOEC-UHFFFAOYSA-N |
Chemical Property Profile of 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione
Property Insights of 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione. The TPSA of 96.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione?
The CAS number of 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione is 162265-47-6.
What is the molecular formula of 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione?
The molecular formula of 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione is C19H13N3O4.
What is the molecular weight of 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione?
The molecular weight of 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione is 347.0906 g/mol.
Where can I buy 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione?
You can request a quote for 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione?
Yes, CoreyChem provides custom synthesis services for 5-Nitro-2-(2-pyridin-2-ylethyl)benzo(de)isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.