4-Nitrothalidomide
TL;DR: 4-Nitrothalidomide (CAS 19171-18-7) is a chemical compound with molecular formula C13H9N3O6 and molecular weight 303.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,6-dioxopiperidin-3-yl)-4-nitroisoindole-1,3-dione
Also Known As: 4-Nitrothalidomide, 3-Nitrothalidomide, 2-(2,6-dioxopiperidin-3-yl)-4-nitroisoindoline-1,3-dione, Nitrothalidomide, Pomalidomide Impurity 5
| Molecular Formula | C13H9N3O6 |
|---|---|
| Molecular Weight | 303.05 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 303.04913 |
| Heavy Atoms | 22 |
| Complexity | 583.0 |
Chemical Identifiers
| CAS Number | 19171-18-7 |
|---|---|
| SMILES | C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] |
| InChIKey | KVRCAGKHAZRSQX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Nitrothalidomide (CAS 19171-18-7), with molecular formula C13H9N3O6 and molecular weight 303.05 g/mol. IUPAC: 2-(2,6-dioxopiperidin-3-yl)-4-nitroisoindole-1,3-dione.
Chemical Property Profile of 4-Nitrothalidomide
Property Insights of 4-Nitrothalidomide
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrothalidomide. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrothalidomide. Following Lipinski's Rule of Five, 4-Nitrothalidomide 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-Nitrothalidomide?
The CAS number of 4-Nitrothalidomide is 19171-18-7.
What is the molecular formula of 4-Nitrothalidomide?
The molecular formula of 4-Nitrothalidomide is C13H9N3O6.
What is the molecular weight of 4-Nitrothalidomide?
The molecular weight of 4-Nitrothalidomide is 303.05 g/mol.
Where can I buy 4-Nitrothalidomide?
You can request a quote for 4-Nitrothalidomide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrothalidomide?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrothalidomide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.