N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride
TL;DR: N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride (CAS 81417-00-7) is a chemical compound with molecular formula C9H11FN6O3 and molecular weight 270.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-aminoethyl)-4-azido-2-nitrobenzamide;hydrofluoride
Also Known As: N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride, N-(2-aminoethyl)-4-azido-2-nitrobenzamide hydrofluoride, Benzamide, N-(2-aminoethyl)-4-azido-2-nitro-, monohydrofluoride, N-(2-aminoethyl)-4-azido-2-nitrobenzamide,hydrofluoride, N-(2-Aminoethyl)-4-azido-2-nitrobenzamide--hydrogen fluoride (1/1)
| Molecular Formula | C9H11FN6O3 |
|---|---|
| Molecular Weight | 270.09 g/mol |
| LogP | 1.3776 |
| Topological Polar Surface Area | 147.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.08768 |
| Heavy Atoms | 19 |
| Complexity | 528.6863 |
Chemical Identifiers
| CAS Number | 81417-00-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])C(=O)NCCN.F |
Product Overview
N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride (CAS 81417-00-7), with molecular formula C9H11FN6O3 and molecular weight 270.09 g/mol. IUPAC: N-(2-aminoethyl)-4-azido-2-nitrobenzamide;hydrofluoride.
Chemical Property Profile of N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride
Property Insights of N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride
The XLogP value of 1.3776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride. The TPSA of 147.02 Ų indicates high polarity, suggesting N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride has 2 hydrogen bond donor(s) and 5 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-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride?
The CAS number of N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride is 81417-00-7.
What is the molecular formula of N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride?
The molecular formula of N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride is C9H11FN6O3.
What is the molecular weight of N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride?
The molecular weight of N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride is 270.09 g/mol.
Where can I buy N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride?
You can request a quote for N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.