![[5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate structure](/static/products/3058/305854-22-2.webp)
[5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate
TL;DR: [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate (CAS 305854-22-2) is a chemical compound with molecular formula C22H15ClN4O4S and molecular weight 466.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-methyl-4-(2-nitrophenyl)sulfanyl-1-phenylpyrazol-5-yl] 2-chloropyridine-3-carboxylate
Also Known As: [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate, [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenylpyrazol-3-yl] 2-chloropyridine-3-carboxylate, 3-methyl-4-[(2-nitrophenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-yl 2-chloropyridine-3-carboxylate
| Molecular Formula | C22H15ClN4O4S |
|---|---|
| Molecular Weight | 466.05 g/mol |
| LogP | 5.50772 |
| Topological Polar Surface Area | 100.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 466.05026 |
| Heavy Atoms | 32 |
| Complexity | 1310.546 |
Chemical Identifiers
| CAS Number | 305854-22-2 |
|---|---|
| SMILES | CC1=NN(C(=C1SC2=CC=CC=C2[N+](=O)[O-])OC(=O)C3=C(N=CC=C3)Cl)C4=CC=CC=C4 |
Product Overview
[5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate (CAS 305854-22-2), with molecular formula C22H15ClN4O4S and molecular weight 466.05 g/mol. IUPAC: [3-methyl-4-(2-nitrophenyl)sulfanyl-1-phenylpyrazol-5-yl] 2-chloropyridine-3-carboxylate.
Chemical Property Profile of [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate
Property Insights of [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate
The XLogP value of 5.50772 indicates that [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.15 Ų falls within the moderate polarity range, balancing permeability and solubility for [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate?
The CAS number of [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate is 305854-22-2.
What is the molecular formula of [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate?
The molecular formula of [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate is C22H15ClN4O4S.
What is the molecular weight of [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate?
The molecular weight of [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate is 466.05 g/mol.
Where can I buy [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate?
You can request a quote for [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [5-methyl-4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.