2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole
TL;DR: 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole (CAS 97945-32-9) is a chemical compound with molecular formula C12H15N3O2 and molecular weight 233.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-bicyclo[2.2.1]heptanylidenemethyl]-1-methyl-5-nitroimidazole
Also Known As: 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole, 1H-Imidazole, 2-(bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-, 1-Methyl-2-[(norbornan-2-ylidene)methyl]-5-nitro-1H-imidazole, 2-({bicyclo[2.2.1]heptan-2-ylidene}methyl)-1-methyl-5-nitro-1H-imidazole, 2-[(E)-3-bicyclo[2.2.1]heptanylidenemethyl]-1-methyl-5-nitroimidazole
| Molecular Formula | C12H15N3O2 |
|---|---|
| Molecular Weight | 233.12 g/mol |
| LogP | 2.5317 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.11642 |
| Heavy Atoms | 17 |
| Complexity | 503.84906 |
Chemical Identifiers
| CAS Number | 97945-32-9 |
|---|---|
| SMILES | CN1C(=CN=C1/C=C/2\CC3CCC2C3)[N+](=O)[O-] |
Product Overview
2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole (CAS 97945-32-9), with molecular formula C12H15N3O2 and molecular weight 233.12 g/mol. IUPAC: 2-[(E)-2-bicyclo[2.2.1]heptanylidenemethyl]-1-methyl-5-nitroimidazole.
Chemical Property Profile of 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole
Property Insights of 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole
The XLogP value of 2.5317 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole. Following Lipinski's Rule of Five, 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole 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
Frequently Asked Questions
What is the CAS number of 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole?
The CAS number of 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole is 97945-32-9.
What is the molecular formula of 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole?
The molecular formula of 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole is C12H15N3O2.
What is the molecular weight of 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole?
The molecular weight of 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole is 233.12 g/mol.
Where can I buy 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole?
You can request a quote for 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(Bicyclo(2.2.1)hept-2-ylidenemethyl)-1-methyl-5-nitro-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.