4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide
TL;DR: 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide (CAS 313692-91-0) is a chemical compound with molecular formula C16H15N3O and molecular weight 265.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4,4-dimethyl-1-oxido-5-phenylimidazol-1-ium-2-yl)pyridine
Also Known As: 3-(4,4-dimethyl-1-oxido-5-phenylimidazol-1-ium-2-yl)pyridine, 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide
| Molecular Formula | C16H15N3O |
|---|---|
| Molecular Weight | 265.12 g/mol |
| LogP | 2.62 |
| Topological Polar Surface Area | 51.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.12152 |
| Heavy Atoms | 20 |
| Complexity | 688.17664 |
Chemical Identifiers
| CAS Number | 313692-91-0 |
|---|---|
| SMILES | CC1(C(=[N+](C(=N1)C2=CN=CC=C2)[O-])C3=CC=CC=C3)C |
Product Overview
4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide (CAS 313692-91-0), with molecular formula C16H15N3O and molecular weight 265.12 g/mol. IUPAC: 3-(4,4-dimethyl-1-oxido-5-phenylimidazol-1-ium-2-yl)pyridine.
Chemical Property Profile of 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide
Property Insights of 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide
The XLogP value of 2.62 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide. With a topological polar surface area (TPSA) of 51.32 Ų, 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide 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 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide?
The CAS number of 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide is 313692-91-0.
What is the molecular formula of 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide?
The molecular formula of 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide is C16H15N3O.
What is the molecular weight of 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide?
The molecular weight of 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide is 265.12 g/mol.
Where can I buy 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide?
You can request a quote for 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 4,4-dimethyl-5-phenyl-2-(pyridin-3-yl)-4H-imidazole 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.