3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate
TL;DR: 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate (CAS 331672-46-9) is a chemical compound with molecular formula C25H14N2O6 and molecular weight 438.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-nitrophenyl) 2-naphthalen-1-yl-1,3-dioxoisoindole-5-carboxylate
Also Known As: BAS 00396824, 3-nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate, (3-nitrophenyl) 2-naphthalen-1-yl-1,3-dioxoisoindole-5-carboxylate
| Molecular Formula | C25H14N2O6 |
|---|---|
| Molecular Weight | 438.09 g/mol |
| LogP | 4.7678 |
| Topological Polar Surface Area | 106.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.08517 |
| Heavy Atoms | 33 |
| Complexity | 1488.2699 |
Chemical Identifiers
| CAS Number | 331672-46-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)OC5=CC=CC(=C5)[N+](=O)[O-] |
Product Overview
3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate (CAS 331672-46-9), with molecular formula C25H14N2O6 and molecular weight 438.09 g/mol. IUPAC: (3-nitrophenyl) 2-naphthalen-1-yl-1,3-dioxoisoindole-5-carboxylate.
Chemical Property Profile of 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate
Property Insights of 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate
The XLogP value of 4.7678 indicates that 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate. Following Lipinski's Rule of Five, 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate has 0 hydrogen bond donor(s) and 6 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 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate?
The CAS number of 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate is 331672-46-9.
What is the molecular formula of 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate?
The molecular formula of 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate is C25H14N2O6.
What is the molecular weight of 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate?
The molecular weight of 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate is 438.09 g/mol.
Where can I buy 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate?
You can request a quote for 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitrophenyl 2-(1-naphthyl)-1,3-dioxo-5-isoindolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.