![2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione structure](/static/products/4425/442568-82-3.webp)
2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione
TL;DR: 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione (CAS 442568-82-3) is a chemical compound with molecular formula C22H13N3O4 and molecular weight 383.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(8-methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione
Also Known As: BAS 04795729, 2-(8-Methyl-quinolin-5-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione, 2-(8-methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione, 2-(8-methylquinolin-5-yl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione, 2-(8-METHYL-5-QUINOLYL)-6-NITRO-1H-BENZO[DE]ISOQUINOLINE-1,3(2H)-DIONE
| Molecular Formula | C22H13N3O4 |
|---|---|
| Molecular Weight | 383.09 g/mol |
| LogP | 4.40522 |
| Topological Polar Surface Area | 93.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 383.0906 |
| Heavy Atoms | 29 |
| Complexity | 1371.7302 |
Chemical Identifiers
| CAS Number | 442568-82-3 |
|---|---|
| SMILES | CC1=C2C(=C(C=C1)N3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O)C=CC=N2 |
Product Overview
2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione (CAS 442568-82-3), with molecular formula C22H13N3O4 and molecular weight 383.09 g/mol. IUPAC: 2-(8-methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione
Property Insights of 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione
The XLogP value of 4.40522 indicates that 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[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
Frequently Asked Questions
What is the CAS number of 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
The CAS number of 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione is 442568-82-3.
What is the molecular formula of 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
The molecular formula of 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione is C22H13N3O4.
What is the molecular weight of 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
The molecular weight of 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione is 383.09 g/mol.
Where can I buy 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
You can request a quote for 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[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-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(8-Methylquinolin-5-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.