N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide
TL;DR: N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide (CAS 29941-70-6) is a chemical compound with molecular formula C6H8N4O3 and molecular weight 184.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide
Also Known As: N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide, alpha-(1-Methyl-5-nitroimidazol-2-yl)-N-methylnitrone, N-Methyl(1-methyl-5-nitro-1H-imidazol-2-yl)methanimine N-oxide, Methanamine,N-[(1-methyl-5-nitro-1H-imidazol-2-yl)methylene]-, N-oxide (9CI)
| Molecular Formula | C6H8N4O3 |
|---|---|
| Molecular Weight | 184.06 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.05965 |
| Heavy Atoms | 13 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 29941-70-6 |
|---|---|
| SMILES | CN1C(=CN=C1C=[N+](C)[O-])[N+](=O)[O-] |
| InChIKey | JPGSNNPGOCFQJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide (CAS 29941-70-6), with molecular formula C6H8N4O3 and molecular weight 184.06 g/mol. IUPAC: N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide.
Chemical Property Profile of N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide
Property Insights of N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide. Following Lipinski's Rule of Five, N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide 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-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide?
The CAS number of N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide is 29941-70-6.
What is the molecular formula of N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide?
The molecular formula of N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide is C6H8N4O3.
What is the molecular weight of N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide?
The molecular weight of N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide is 184.06 g/mol.
Where can I buy N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide?
You can request a quote for N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-1-(1-methyl-5-nitroimidazol-2-yl)methanimine oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.