5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide
TL;DR: 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide (CAS 122981-36-6) is a chemical compound with molecular formula C17H17N3O4 and molecular weight 327.12192 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-4,4-dimethyl-2-(3-nitrophenyl)-1-oxido-5-phenyl-2H-imidazol-1-ium
Also Known As: 1-hydroxy-5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazole 3-oxide, 3-hydroxy-4,4-dimethyl-2-(3-nitrophenyl)-1-oxido-5-phenyl-2H-imidazol-1-ium, 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide
Technical Specifications
| Molecular Formula | C17H17N3O4 |
| Molecular Weight | 327.12192 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 98.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.12192 Da |
| Heavy Atoms | 24 |
| Complexity | 522.0 |
| SMILES | CC1(C(=[N+](C(N1O)C2=CC(=CC=C2)[N+](=O)[O-])[O-])C3=CC=CC=C3)C |
| InChIKey | DLSNOHLXYLDSDI-UHFFFAOYSA-N |
Chemical Property Profile of 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide
Property Insights of 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide. Following Lipinski's Rule of Five, 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide?
The CAS number of 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide is 122981-36-6.
What is the molecular formula of 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide?
The molecular formula of 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide is C17H17N3O4.
What is the molecular weight of 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide?
The molecular weight of 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide is 327.12192 g/mol.
Where can I buy 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide?
You can request a quote for 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide?
Yes, CoreyChem provides custom synthesis services for 5,5-dimethyl-2-(3-nitrophenyl)-4-phenyl-2,5-dihydro-1H-imidazol-1-ol 3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.