(E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime
TL;DR: (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime (CAS 381209-92-3) is a chemical compound with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NE)-N-[[3-[4-(2-methylpropoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]hydroxylamine
Also Known As: (E)-N-({3-[4-(2-methylpropoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)hydroxylamine, BRD-K31988640-001-01-8, F1218-0700, (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime, (NE)-N-[[3-[4-(2-methylpropoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]hydroxylamine
| Molecular Formula | C20H21N3O2 |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 4.3822 |
| Topological Polar Surface Area | 59.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 335.1634 |
| Heavy Atoms | 25 |
| Complexity | 837.13763 |
Chemical Identifiers
| CAS Number | 381209-92-3 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)C2=NN(C=C2/C=N/O)C3=CC=CC=C3 |
Product Overview
(E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime (CAS 381209-92-3), with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol. IUPAC: (NE)-N-[[3-[4-(2-methylpropoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]hydroxylamine.
Chemical Property Profile of (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime
Property Insights of (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime
The XLogP value of 4.3822 indicates that (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.64 Ų, (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime 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 (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime?
The CAS number of (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime is 381209-92-3.
What is the molecular formula of (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime?
The molecular formula of (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime is C20H21N3O2.
What is the molecular weight of (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime?
The molecular weight of (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime is 335.16 g/mol.
Where can I buy (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime?
You can request a quote for (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.