TL;DR: CTK8J6770 (CAS 62143-88-8) is a chemical compound with molecular formula C9H12N4O3 and molecular weight 224.09094 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-4-(3-methyl-2-nitroimidazol-4-yl)but-3-en-2-imine oxide
Also Known As: N-Methyl-N-[3-(1-methyl-2-nitro-1H-imidazol-5-yl)-1-methyl-2-propenylidene]amine oxide
| Molecular Formula | C9H12N4O3 |
| Molecular Weight | 224.09094 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.09094 Da |
| Heavy Atoms | 16 |
| Complexity | 334.0 |
| SMILES | CC(=[N+](C)[O-])C=CC1=CN=C(N1C)[N+](=O)[O-] |
| InChIKey | VGWCHPMDTJPNML-UHFFFAOYSA-N |
The XLogP value of -0.4 indicates that CTK8J6770 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK8J6770. Following Lipinski's Rule of Five, CTK8J6770 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CTK8J6770 is 62143-88-8.
The molecular formula of CTK8J6770 is C9H12N4O3.
The molecular weight of CTK8J6770 is 224.09094 g/mol.
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