4',5-Dibromo-3-nitrosalicylanilide
TL;DR: 4',5-Dibromo-3-nitrosalicylanilide (CAS 38339-11-6) is a chemical compound with molecular formula C13H8Br2N2O4 and molecular weight 413.88507 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-N-(4-bromophenyl)-2-hydroxy-3-nitrobenzamide
Also Known As: 4',5-Dibromo-3-nitrosalicylanilide, NSSC 82019, Salicyanilide, 4',5-dibromo-3-nitro-, 5-bromo-n-(4-bromophenyl)-2-hydroxy-3-nitrobenzamide, NCI60_041796
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H8Br2N2O4 |
| Molecular Weight | 413.88507 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 413.88507 Da |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
| SMILES | C1=CC(=CC=C1NC(=O)C2=C(C(=CC(=C2)Br)[N+](=O)[O-])O)Br |
| InChIKey | IXPKEGDIYPGSLP-UHFFFAOYSA-N |
Chemical Property Profile of 4',5-Dibromo-3-nitrosalicylanilide
Property Insights of 4',5-Dibromo-3-nitrosalicylanilide
The XLogP value of 4.2 indicates that 4',5-Dibromo-3-nitrosalicylanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4',5-Dibromo-3-nitrosalicylanilide. Following Lipinski's Rule of Five, 4',5-Dibromo-3-nitrosalicylanilide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4',5-Dibromo-3-nitrosalicylanilide?
The CAS number of 4',5-Dibromo-3-nitrosalicylanilide is 38339-11-6.
What is the molecular formula of 4',5-Dibromo-3-nitrosalicylanilide?
The molecular formula of 4',5-Dibromo-3-nitrosalicylanilide is C13H8Br2N2O4.
What is the molecular weight of 4',5-Dibromo-3-nitrosalicylanilide?
The molecular weight of 4',5-Dibromo-3-nitrosalicylanilide is 413.88507 g/mol.
Where can I buy 4',5-Dibromo-3-nitrosalicylanilide?
You can request a quote for 4',5-Dibromo-3-nitrosalicylanilide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4',5-Dibromo-3-nitrosalicylanilide?
Yes, CoreyChem provides custom synthesis services for 4',5-Dibromo-3-nitrosalicylanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.