N-Nitrophthalamide
TL;DR: N-Nitrophthalamide (CAS 5336-97-0) is a chemical compound with molecular formula C8H4N2O4 and molecular weight 192.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitroisoindole-1,3-dione
Also Known As: N-Nitrophthalamide, N-Nitro-phthalimide, 2-nitroisoindole-1,3-dione, Phthalimide, N-nitro-, N-NITROPHTHALIMIDE
| Molecular Formula | C8H4N2O4 |
|---|---|
| Molecular Weight | 192.02 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 192.0171 |
| Heavy Atoms | 14 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 5336-97-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)[N+](=O)[O-] |
| InChIKey | JKLDLZVPEFRPLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Nitrophthalamide (CAS 5336-97-0), with molecular formula C8H4N2O4 and molecular weight 192.02 g/mol. IUPAC: 2-nitroisoindole-1,3-dione.
Chemical Property Profile of N-Nitrophthalamide
Property Insights of N-Nitrophthalamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nitrophthalamide. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Nitrophthalamide. Following Lipinski's Rule of Five, N-Nitrophthalamide has 0 hydrogen bond donor(s) and 4 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 N-Nitrophthalamide?
The CAS number of N-Nitrophthalamide is 5336-97-0.
What is the molecular formula of N-Nitrophthalamide?
The molecular formula of N-Nitrophthalamide is C8H4N2O4.
What is the molecular weight of N-Nitrophthalamide?
The molecular weight of N-Nitrophthalamide is 192.02 g/mol.
Where can I buy N-Nitrophthalamide?
You can request a quote for N-Nitrophthalamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nitrophthalamide?
Yes, KEHONG BIO provides custom synthesis services for N-Nitrophthalamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.