2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol
TL;DR: 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol (CAS 32097-42-0) is a chemical compound with molecular formula C12H13N3O3 and molecular weight 247.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methyl-5-nitroimidazol-2-yl)-1-phenylethanol
Also Known As: 2-(1-methyl-5-nitroimidazol-2-yl)-1-phenylethanol, 2-(1-methyl-5-nitro-1H-imidazol-2-yl)-1-phenyletha, 2-(1-METHYL-5-NITRO-2-IMIDAZOLYL)-1-PHENYL-1-ETHANOL, 2-(1-Methyl-5-nitro-1H-imidazol-2-yl)-1-phenylethan-1-ol, 659-686-0
| Molecular Formula | C12H13N3O3 |
|---|---|
| Molecular Weight | 247.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.09569 |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 32097-42-0 |
|---|---|
| SMILES | CN1C(=CN=C1CC(C2=CC=CC=C2)O)[N+](=O)[O-] |
| InChIKey | XEJAYLYHPVQENE-UHFFFAOYSA-N |
Product Overview
2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol (CAS 32097-42-0), with molecular formula C12H13N3O3 and molecular weight 247.10 g/mol. IUPAC: 2-(1-methyl-5-nitroimidazol-2-yl)-1-phenylethanol.
Chemical Property Profile of 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol
Property Insights of 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol. Following Lipinski's Rule of Five, 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol has 1 hydrogen bond donor(s) and 4 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-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol?
The CAS number of 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol is 32097-42-0.
What is the molecular formula of 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol?
The molecular formula of 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol is C12H13N3O3.
What is the molecular weight of 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol?
The molecular weight of 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol is 247.10 g/mol.
Where can I buy 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol?
You can request a quote for 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Methyl-5-nitro-2-imidazolyl)-1-phenyl-1-ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.