![4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one structure](/static/products/118/118027-20-6.webp)
4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one
TL;DR: 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one (CAS 118027-20-6) is a chemical compound with molecular formula C14H16N4O4 and molecular weight 304.11716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-methoxyethyliminomethyl)-5-methyl-2-(4-nitrophenyl)-1H-pyrazol-3-one
Also Known As: 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one, (E)-4-(((2-methoxyethyl)amino)methylene)-3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5(4H)-one
Technical Specifications
| Molecular Formula | C14H16N4O4 |
| Molecular Weight | 304.11716 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 99.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.11716 Da |
| Heavy Atoms | 22 |
| Complexity | 490.0 |
| SMILES | CC1=C(C(=O)N(N1)C2=CC=C(C=C2)[N+](=O)[O-])C=NCCOC |
| InChIKey | NONZYWZJZBIKOC-UHFFFAOYSA-N |
Chemical Property Profile of 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one
Property Insights of 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one. The TPSA of 99.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one. Following Lipinski's Rule of Five, 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one?
The CAS number of 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one is 118027-20-6.
What is the molecular formula of 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one?
The molecular formula of 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one is C14H16N4O4.
What is the molecular weight of 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one?
The molecular weight of 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one is 304.11716 g/mol.
Where can I buy 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one?
You can request a quote for 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one?
Yes, CoreyChem provides custom synthesis services for 4-[(2-methoxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.