RefChem:1058021
TL;DR: RefChem:1058021 (CAS 117941-43-2) is a chemical compound with molecular formula C14H20Cl2N6O2-4 and molecular weight 374.10248 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-[1-methyl-3-[(E)-4-[3-methyl-2-[(E)-oxidoiminomethyl]-2H-imidazol-1-yl]but-3-enyl]-2H-imidazol-2-yl]-N-oxidomethanimine dichloride
Also Known As: 1H-Imidazolium, 1,4-(tetramethylene)bis(2-((hydroxyimino)methyl)-3-methyl-, dichloride, 1,4-(Tetramethylene)bis(2-((hydroxyimino)methyl)-3-methyl-1H-imidazolium chloride)
Technical Specifications
| Molecular Formula | C14H20Cl2N6O2-4 |
| Molecular Weight | 374.10248 g/mol |
| XLogP | -4.8752 |
| Topological Polar Surface Area (TPSA) | 83.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 374.10248 Da |
| Heavy Atoms | 24 |
| Complexity | 502.0 |
| SMILES | CN1C=CN(C1/C=N/[O-])CC/C=C/N2C=CN(C2/C=N/[O-])C.[Cl-].[Cl-] |
| InChIKey | HZYNTSFITSWAOZ-VRZWEYCWSA-J |
Chemical Property Profile of RefChem:1058021
Property Insights of RefChem:1058021
The XLogP value of -4.8752 indicates that RefChem:1058021 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1058021. Following Lipinski's Rule of Five, RefChem:1058021 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1058021?
The CAS number of RefChem:1058021 is 117941-43-2.
What is the molecular formula of RefChem:1058021?
The molecular formula of RefChem:1058021 is C14H20Cl2N6O2-4.
What is the molecular weight of RefChem:1058021?
The molecular weight of RefChem:1058021 is 374.10248 g/mol.
Where can I buy RefChem:1058021?
You can request a quote for RefChem:1058021 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1058021?
Yes, CoreyChem provides custom synthesis services for RefChem:1058021 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.