N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺
TL;DR: N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 (CAS 114928-08-4) is a chemical compound with molecular formula C13H8BrN3O6 and molecular weight 380.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺
N-(4-bromophenyl)-2-hydroxy-3,5-dinitrobenzamide
Also Known As: n-(4-bromophenyl)-2-hydroxy-3,5-dinitrobenzamide, Benzamide,n-(4-bromophenyl)-2-hydroxy-3,5-dinitro-
| Molecular Formula | C13H8BrN3O6 |
|---|---|
| Molecular Weight | 380.96 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.95966 |
| Heavy Atoms | 23 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 114928-08-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O)Br |
| InChIKey | NPGDASRIRYDUMP-UHFFFAOYSA-N |
Product Overview
N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 (CAS 114928-08-4), with molecular formula C13H8BrN3O6 and molecular weight 380.96 g/mol. IUPAC: N-(4-bromophenyl)-2-hydroxy-3,5-dinitrobenzamide.
Chemical Property Profile of N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺
Property Insights of N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺
The XLogP value of 3.3 indicates that N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 has 2 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 N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺?
The CAS number of N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 is 114928-08-4.
What is the molecular formula of N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺?
The molecular formula of N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 is C13H8BrN3O6.
What is the molecular weight of N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺?
The molecular weight of N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 is 380.96 g/mol.
Where can I buy N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺?
You can request a quote for N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-(4-溴苯基)-2-羟基-3,5-二硝基苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.