N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine
TL;DR: N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine (CAS 10173-66-7) is a chemical compound with molecular formula C13H10N4O4 and molecular weight 286.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-2-[(2-nitrophenyl)methylideneamino]aniline
Also Known As: 4-nitro-2-[(2-nitrophenyl)methylideneamino]aniline, N1-(2-NITROBENZYLIDENE)-5-NITRO-1,2-PHENYLENEDIAMINE, (E)-N1-(2-nitrobenzylidene)-5-nitrobenzene-1,2-diamine, 660-166-0, RefChem:831374
| Molecular Formula | C13H10N4O4 |
|---|---|
| Molecular Weight | 286.07 g/mol |
| LogP | 2.8358 |
| Topological Polar Surface Area | 124.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.0702 |
| Heavy Atoms | 21 |
| Complexity | 742.7012 |
Chemical Identifiers
| CAS Number | 10173-66-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NC2=C(C=CC(=C2)[N+](=O)[O-])N)[N+](=O)[O-] |
Product Overview
N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine (CAS 10173-66-7), with molecular formula C13H10N4O4 and molecular weight 286.07 g/mol. IUPAC: 4-nitro-2-[(2-nitrophenyl)methylideneamino]aniline.
Chemical Property Profile of N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine
Property Insights of N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine
The XLogP value of 2.8358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine. The TPSA of 124.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine. Following Lipinski's Rule of Five, N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine 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 N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine?
The CAS number of N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine is 10173-66-7.
What is the molecular formula of N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine?
The molecular formula of N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine is C13H10N4O4.
What is the molecular weight of N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine?
The molecular weight of N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine is 286.07 g/mol.
Where can I buy N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine?
You can request a quote for N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine?
Yes, KEHONG BIO provides custom synthesis services for N1-(2-Nitrobenzylidene)-5-nitro-1,2-phenylenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.