1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine
TL;DR: 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine (CAS 63551-61-1) is a chemical compound with molecular formula C12H12N4O3 and molecular weight 260.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine
Also Known As: (E)-1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethani, 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine
| Molecular Formula | C12H12N4O3 |
|---|---|
| Molecular Weight | 260.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 85.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.09094 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 63551-61-1 |
|---|---|
| SMILES | CN1C(=CN=C1[N+](=O)[O-])C=NOCC2=CC=CC=C2 |
| InChIKey | YGMPFCBSQAIWFG-UHFFFAOYSA-N |
Product Overview
1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine (CAS 63551-61-1), with molecular formula C12H12N4O3 and molecular weight 260.09 g/mol. IUPAC: 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine.
Chemical Property Profile of 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine
Property Insights of 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine. Following Lipinski's Rule of Five, 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine has 0 hydrogen bond donor(s) and 5 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 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine?
The CAS number of 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine is 63551-61-1.
What is the molecular formula of 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine?
The molecular formula of 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine is C12H12N4O3.
What is the molecular weight of 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine?
The molecular weight of 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine is 260.09 g/mol.
Where can I buy 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine?
You can request a quote for 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-methyl-2-nitroimidazol-4-yl)-N-phenylmethoxymethanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.