![4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile structure](/static/products/3554/355425-91-1.webp)
4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile
TL;DR: 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile (CAS 355425-91-1) is a chemical compound with molecular formula C15H6Cl2N4O4 and molecular weight 375.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5,6-dichloro-1,3-dioxoisoindol-2-yl)amino]-3-nitrobenzonitrile
Also Known As: 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile, 4-[(5,6-dichloro-1,3-dioxoisoindol-2-yl)amino]-3-nitrobenzonitrile, 4-((5,6-dichloro-1,3-dioxoisoindolin-2-yl)amino)-3-nitrobenzonitrile
| Molecular Formula | C15H6Cl2N4O4 |
|---|---|
| Molecular Weight | 375.98 g/mol |
| LogP | 3.39638 |
| Topological Polar Surface Area | 116.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.97662 |
| Heavy Atoms | 25 |
| Complexity | 958.75635 |
Chemical Identifiers
| CAS Number | 355425-91-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1C#N)[N+](=O)[O-])NN2C(=O)C3=CC(=C(C=C3C2=O)Cl)Cl |
Product Overview
4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile (CAS 355425-91-1), with molecular formula C15H6Cl2N4O4 and molecular weight 375.98 g/mol. IUPAC: 4-[(5,6-dichloro-1,3-dioxoisoindol-2-yl)amino]-3-nitrobenzonitrile.
Chemical Property Profile of 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile
Property Insights of 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile
The XLogP value of 3.39638 indicates that 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile. Following Lipinski's Rule of Five, 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile has 1 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 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile?
The CAS number of 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile is 355425-91-1.
What is the molecular formula of 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile?
The molecular formula of 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile is C15H6Cl2N4O4.
What is the molecular weight of 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile?
The molecular weight of 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile is 375.98 g/mol.
Where can I buy 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile?
You can request a quote for 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)amino]-3-nitrobenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.