2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide
TL;DR: 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide (CAS 54371-59-4) is a chemical compound with molecular formula C16H11N3O5 and molecular weight 325.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)-N-(3-nitrophenyl)acetamide
Also Known As: 2-(1,3-dioxoisoindol-2-yl)-N-(3-nitrophenyl)acetamide, 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide, 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(3-nitrophenyl)acetamide, 2-(1,3-dioxobenzo[c]azolidin-2-yl)-N-(3-nitrophenyl)acetamide, 2-(1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOL-2-YL)-N-(3-NITROPHENYL)ACETAMIDE
| Molecular Formula | C16H11N3O5 |
|---|---|
| Molecular Weight | 325.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.0699 |
| Heavy Atoms | 24 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 54371-59-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-] |
| InChIKey | IXLBXRJLVSNXEY-UHFFFAOYSA-N |
Product Overview
2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide (CAS 54371-59-4), with molecular formula C16H11N3O5 and molecular weight 325.07 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)-N-(3-nitrophenyl)acetamide.
Chemical Property Profile of 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide
Property Insights of 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide. Following Lipinski's Rule of Five, 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide has 1 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-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide?
The CAS number of 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide is 54371-59-4.
What is the molecular formula of 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide?
The molecular formula of 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide is C16H11N3O5.
What is the molecular weight of 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide?
The molecular weight of 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide is 325.07 g/mol.
Where can I buy 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide?
You can request a quote for 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.