N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine
TL;DR: N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine (CAS 129661-55-8) is a chemical compound with molecular formula C11H10N4O2 and molecular weight 230.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-methyl-5-nitroimidazol-2-yl)-N-phenylmethanimine
Also Known As: N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine, 1-(1-methyl-5-nitroimidazol-2-yl)-N-phenylmethanimine, methyl-1 phenyliminomethyl-2 nitro-5 imidazole, (E)-1-(1-Methyl-5-nitro-1H-imidazol-2-yl)-N-phenylmethanimine, 1-(1-METHYL-5-NITRO-IMIDAZOL-2-YL)-N-PHENYL-METHANIMINE
| Molecular Formula | C11H10N4O2 |
|---|---|
| Molecular Weight | 230.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.08037 |
| Heavy Atoms | 17 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 129661-55-8 |
|---|---|
| SMILES | CN1C(=CN=C1C=NC2=CC=CC=C2)[N+](=O)[O-] |
| InChIKey | RQBDVCWIRHAMMD-UHFFFAOYSA-N |
Product Overview
N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine (CAS 129661-55-8), with molecular formula C11H10N4O2 and molecular weight 230.08 g/mol. IUPAC: 1-(1-methyl-5-nitroimidazol-2-yl)-N-phenylmethanimine.
Chemical Property Profile of N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine
Property Insights of N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine. Following Lipinski's Rule of Five, N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine has 0 hydrogen bond donor(s) and 4 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-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine?
The CAS number of N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine is 129661-55-8.
What is the molecular formula of N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine?
The molecular formula of N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine is C11H10N4O2.
What is the molecular weight of N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine?
The molecular weight of N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine is 230.08 g/mol.
Where can I buy N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine?
You can request a quote for N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine?
Yes, KEHONG BIO provides custom synthesis services for N-((1-Methyl-5-nitro-1H-imidazol-2-yl)methylene)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.