1-Methyl-4-phenyl-5-nitrosoimidazole
TL;DR: 1-Methyl-4-phenyl-5-nitrosoimidazole (CAS 111380-08-6) is a chemical compound with molecular formula C10H9N3O and molecular weight 187.07455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-5-nitroso-4-phenylimidazole
Also Known As: 1-Methyl-4-phenyl-5-nitrosoimidazole, MPNI, 1-methyl-5-nitroso-4-phenylimidazole, 1-Methyl-5-nitroso-4-phenyl-1H-imidazole, 1H-Imidazole, 1-methyl-5-nitroso-4-phenyl-
Technical Specifications
| Molecular Formula | C10H9N3O |
| Molecular Weight | 187.07455 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.07455 Da |
| Heavy Atoms | 14 |
| Complexity | 204.0 |
| SMILES | CN1C=NC(=C1N=O)C2=CC=CC=C2 |
| InChIKey | GFYCENKHMQJSCM-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methyl-4-phenyl-5-nitrosoimidazole
Property Insights of 1-Methyl-4-phenyl-5-nitrosoimidazole
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-phenyl-5-nitrosoimidazole. With a topological polar surface area (TPSA) of 47.3 Ų, 1-Methyl-4-phenyl-5-nitrosoimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-phenyl-5-nitrosoimidazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methyl-4-phenyl-5-nitrosoimidazole?
The CAS number of 1-Methyl-4-phenyl-5-nitrosoimidazole is 111380-08-6.
What is the molecular formula of 1-Methyl-4-phenyl-5-nitrosoimidazole?
The molecular formula of 1-Methyl-4-phenyl-5-nitrosoimidazole is C10H9N3O.
What is the molecular weight of 1-Methyl-4-phenyl-5-nitrosoimidazole?
The molecular weight of 1-Methyl-4-phenyl-5-nitrosoimidazole is 187.07455 g/mol.
Where can I buy 1-Methyl-4-phenyl-5-nitrosoimidazole?
You can request a quote for 1-Methyl-4-phenyl-5-nitrosoimidazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methyl-4-phenyl-5-nitrosoimidazole?
Yes, CoreyChem provides custom synthesis services for 1-Methyl-4-phenyl-5-nitrosoimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.