RefChem:1075667
TL;DR: RefChem:1075667 (CAS 107045-02-3) is a chemical compound with molecular formula C22H22N4O3 and molecular weight 390.1692 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[(Z)-(3-methyl-5-oxo-1H-pyrazol-4-ylidene)methyl]phenoxy]-N-[(E)-1-(4-methylphenyl)ethylideneamino]acetamide
Also Known As: Acetic acid, (p-((3-methyl-5-oxo-2-pyrazolin-4-ylidene)methyl)phenoxy)-, (alpha-methyl-4-methylbenzylidene)hydrazide, BRN 5638884
Technical Specifications
| Molecular Formula | C22H22N4O3 |
| Molecular Weight | 390.1692 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 92.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.1692 Da |
| Heavy Atoms | 29 |
| Complexity | 697.0 |
| SMILES | CC1=CC=C(C=C1)/C(=N/NC(=O)COC2=CC=C(C=C2)/C=C\3/C(=NNC3=O)C)/C |
| InChIKey | OTLFCNKGUKWQIG-ZGTWPYMLSA-N |
Chemical Property Profile of RefChem:1075667
Property Insights of RefChem:1075667
The XLogP value of 3.2 indicates that RefChem:1075667 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1075667. Following Lipinski's Rule of Five, RefChem:1075667 has 2 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 RefChem:1075667?
The CAS number of RefChem:1075667 is 107045-02-3.
What is the molecular formula of RefChem:1075667?
The molecular formula of RefChem:1075667 is C22H22N4O3.
What is the molecular weight of RefChem:1075667?
The molecular weight of RefChem:1075667 is 390.1692 g/mol.
Where can I buy RefChem:1075667?
You can request a quote for RefChem:1075667 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1075667?
Yes, CoreyChem provides custom synthesis services for RefChem:1075667 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.