![(4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one structure](/static/products/3758/375842-15-2.webp)
(4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one
TL;DR: (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one (CAS 375842-15-2) is a chemical compound with molecular formula C16H18N4O3 and molecular weight 314.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)-4-(prop-2-enyliminomethyl)-5-propyl-1H-pyrazol-3-one
Also Known As: (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one, 2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one, (4Z)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one, (E)-4-((allylamino)methylene)-1-(4-nitrophenyl)-3-propyl-1H-pyrazol-5(4H)-one, 2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propyl-pyrazol-3-one
| Molecular Formula | C16H18N4O3 |
|---|---|
| Molecular Weight | 314.14 g/mol |
| LogP | 2.6312 |
| Topological Polar Surface Area | 93.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 314.13788 |
| Heavy Atoms | 23 |
| Complexity | 784.647 |
Chemical Identifiers
| CAS Number | 375842-15-2 |
|---|---|
| SMILES | CCCC1=C(C(=O)N(N1)C2=CC=C(C=C2)[N+](=O)[O-])C=NCC=C |
Product Overview
(4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one (CAS 375842-15-2), with molecular formula C16H18N4O3 and molecular weight 314.14 g/mol. IUPAC: 2-(4-nitrophenyl)-4-(prop-2-enyliminomethyl)-5-propyl-1H-pyrazol-3-one.
Chemical Property Profile of (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one
Property Insights of (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one
The XLogP value of 2.6312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one. The TPSA of 93.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one. Following Lipinski's Rule of Five, (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one has 1 hydrogen bond donor(s) and 4 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 (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one?
The CAS number of (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one is 375842-15-2.
What is the molecular formula of (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one?
The molecular formula of (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one is C16H18N4O3.
What is the molecular weight of (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one?
The molecular weight of (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one is 314.14 g/mol.
Where can I buy (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one?
You can request a quote for (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4E)-2-(4-nitrophenyl)-4-[(prop-2-enylamino)methylidene]-5-propylpyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.