(E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide
TL;DR: (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide (CAS 714947-32-7) is a chemical compound with molecular formula C20H16F3N5O3 and molecular weight 431.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-methyl-3-nitropyrazol-1-yl)methyl]-N-[(E)-[3-(trifluoromethyl)phenyl]methylideneamino]benzamide
Also Known As: (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide, 4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}benzohydrazide, 4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-[[3-(trifluoromethyl)phenyl]methylideneamino]benzamide, 4-[(5-methyl-3-nitropyrazol-1-yl)methyl]-N-[(E)-[3-(trifluoromethyl)phenyl]methylideneamino]benzamide
| Molecular Formula | C20H16F3N5O3 |
|---|---|
| Molecular Weight | 431.12 g/mol |
| LogP | 3.93072 |
| Topological Polar Surface Area | 102.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.1205 |
| Heavy Atoms | 31 |
| Complexity | 1137.7074 |
Chemical Identifiers
| CAS Number | 714947-32-7 |
|---|---|
| SMILES | CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N/N=C/C3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-] |
Product Overview
(E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide (CAS 714947-32-7), with molecular formula C20H16F3N5O3 and molecular weight 431.12 g/mol. IUPAC: 4-[(5-methyl-3-nitropyrazol-1-yl)methyl]-N-[(E)-[3-(trifluoromethyl)phenyl]methylideneamino]benzamide.
Chemical Property Profile of (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide
Property Insights of (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide
The XLogP value of 3.93072 indicates that (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.42 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide. Following Lipinski's Rule of Five, (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide has 1 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 (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide?
The CAS number of (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide is 714947-32-7.
What is the molecular formula of (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide?
The molecular formula of (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide is C20H16F3N5O3.
What is the molecular weight of (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide?
The molecular weight of (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide is 431.12 g/mol.
Where can I buy (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide?
You can request a quote for (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-((5-methyl-3-nitro-1H-pyrazol-1-yl)methyl)-N'-(3-(trifluoromethyl)benzylidene)benzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.