3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium
TL;DR: 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium (CAS 371214-81-2) is a chemical compound with molecular formula C12H16N2O and molecular weight 204.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium
Also Known As: BIM-0022739.P001, 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium, 1,5,5-trimethyl-4-phenyl-2,5-dihydro-1H-imidazole 3-oxide
| Molecular Formula | C12H16N2O |
|---|---|
| Molecular Weight | 204.13 g/mol |
| LogP | 1.6675 |
| Topological Polar Surface Area | 29.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.12627 |
| Heavy Atoms | 15 |
| Complexity | 395.34296 |
Chemical Identifiers
| CAS Number | 371214-81-2 |
|---|---|
| SMILES | CC1(C(=[N+](CN1C)[O-])C2=CC=CC=C2)C |
Product Overview
3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium (CAS 371214-81-2), with molecular formula C12H16N2O and molecular weight 204.13 g/mol. IUPAC: 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium.
Chemical Property Profile of 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium
Property Insights of 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium
The XLogP value of 1.6675 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium. With a topological polar surface area (TPSA) of 29.31 Ų, 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium has 0 hydrogen bond donor(s) and 2 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 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium?
The CAS number of 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium is 371214-81-2.
What is the molecular formula of 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium?
The molecular formula of 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium is C12H16N2O.
What is the molecular weight of 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium?
The molecular weight of 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium is 204.13 g/mol.
Where can I buy 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium?
You can request a quote for 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 3,4,4-trimethyl-1-oxido-5-phenyl-2H-imidazol-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.