![methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate structure](/static/products/3182/318239-33-7.webp)
methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate
TL;DR: methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate (CAS 318239-33-7) is a chemical compound with molecular formula C21H17ClF3N3O3S and molecular weight 483.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-1-methyl-3-(trifluoromethyl)pyrazol-5-yl]sulfanylbenzoate
Also Known As: methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate, methyl 2-{[4-({[(4-chlorobenzyl)oxy]imino}methyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]sulfanyl}benzenecarboxylate
| Molecular Formula | C21H17ClF3N3O3S |
|---|---|
| Molecular Weight | 483.06 g/mol |
| LogP | 5.5808 |
| Topological Polar Surface Area | 65.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 483.0631 |
| Heavy Atoms | 32 |
| Complexity | 1131.554 |
Chemical Identifiers
| CAS Number | 318239-33-7 |
|---|---|
| SMILES | CN1C(=C(C(=N1)C(F)(F)F)C=NOCC2=CC=C(C=C2)Cl)SC3=CC=CC=C3C(=O)OC |
Product Overview
methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate (CAS 318239-33-7), with molecular formula C21H17ClF3N3O3S and molecular weight 483.06 g/mol. IUPAC: methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-1-methyl-3-(trifluoromethyl)pyrazol-5-yl]sulfanylbenzoate.
Chemical Property Profile of methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate
Property Insights of methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate
The XLogP value of 5.5808 indicates that methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.71 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate. Following Lipinski's Rule of Five, methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate?
The CAS number of methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate is 318239-33-7.
What is the molecular formula of methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate?
The molecular formula of methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate is C21H17ClF3N3O3S.
What is the molecular weight of methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate?
The molecular weight of methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate is 483.06 g/mol.
Where can I buy methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate?
You can request a quote for methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-[4-[(4-chlorophenyl)methoxyiminomethyl]-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]sulfanylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.