(4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
TL;DR: (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one (CAS 67376-76-5) is a chemical compound with molecular formula C18H15N3O4 and molecular weight 337.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-4-[(4-methoxy-3-nitrophenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one
Also Known As: (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, (4Z)-4-[(4-methoxy-3-nitrophenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one, (Z)-4-(4-methoxy-3-nitrobenzylidene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one, (4Z)-4-[(4-METHOXY-3-NITROPHENYL)METHYLIDENE]-3-METHYL-1-PHENYL-4,5-DIHYDRO-1H-PYRAZOL-5-ONE
| Molecular Formula | C18H15N3O4 |
|---|---|
| Molecular Weight | 337.11 g/mol |
| LogP | 3.4095 |
| Topological Polar Surface Area | 85.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.10626 |
| Heavy Atoms | 25 |
| Complexity | 903.7921 |
Chemical Identifiers
| CAS Number | 67376-76-5 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C\C2=CC(=C(C=C2)OC)[N+](=O)[O-])C3=CC=CC=C3 |
Product Overview
(4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one (CAS 67376-76-5), with molecular formula C18H15N3O4 and molecular weight 337.11 g/mol. IUPAC: (4Z)-4-[(4-methoxy-3-nitrophenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one.
Chemical Property Profile of (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Property Insights of (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
The XLogP value of 3.4095 indicates that (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.04 Ų falls within the moderate polarity range, balancing permeability and solubility for (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one. Following Lipinski's Rule of Five, (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one has 0 hydrogen bond donor(s) and 5 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 (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The CAS number of (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is 67376-76-5.
What is the molecular formula of (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular formula of (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is C18H15N3O4.
What is the molecular weight of (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular weight of (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is 337.11 g/mol.
Where can I buy (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
You can request a quote for (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4Z)-4-(4-methoxy-3-nitrobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.