![5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline structure](/static/products/7390/73903-40-9.webp)
5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline
TL;DR: 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline (CAS 73903-40-9) is a chemical compound with molecular formula C17H14N2O4 and molecular weight 310.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-nitrophenyl)methyl]-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline
Also Known As: 5-(2-nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline, 5-[(2-nitrophenyl)methyl]-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline, 5-[(2-nitrophenyl)methyl]-7,8-dihydro-[1,3]dioxolo[4,5-g]iso, 5-[(2-Nitrophenyl)methyl]-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinoline
| Molecular Formula | C17H14N2O4 |
|---|---|
| Molecular Weight | 310.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 76.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.09537 |
| Heavy Atoms | 23 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 73903-40-9 |
|---|---|
| SMILES | C1CN=C(C2=CC3=C(C=C21)OCO3)CC4=CC=CC=C4[N+](=O)[O-] |
| InChIKey | PISSJJSAJXXJEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline (CAS 73903-40-9), with molecular formula C17H14N2O4 and molecular weight 310.10 g/mol. IUPAC: 5-[(2-nitrophenyl)methyl]-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline.
Chemical Property Profile of 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline
Property Insights of 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline. The TPSA of 76.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline. Following Lipinski's Rule of Five, 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline 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 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline?
The CAS number of 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline is 73903-40-9.
What is the molecular formula of 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline?
The molecular formula of 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline is C17H14N2O4.
What is the molecular weight of 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline?
The molecular weight of 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline is 310.10 g/mol.
Where can I buy 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline?
You can request a quote for 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Nitrobenzyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.