[(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate
TL;DR: [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate (CAS 477709-11-8) is a chemical compound with molecular formula C12H10Cl2N4O2 and molecular weight 312.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate
Also Known As: [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate, 2-chloro-5-[({[(E)-(5-chloro-1,3-dimethyl-1H-pyrazol-4-yl)methylidene]amino}oxy)carbonyl]pyridine
| Molecular Formula | C12H10Cl2N4O2 |
|---|---|
| Molecular Weight | 312.02 g/mol |
| LogP | 2.62122 |
| Topological Polar Surface Area | 69.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.01807 |
| Heavy Atoms | 20 |
| Complexity | 664.842 |
Chemical Identifiers
| CAS Number | 477709-11-8 |
|---|---|
| SMILES | CC1=NN(C(=C1C=NOC(=O)C2=CN=C(C=C2)Cl)Cl)C |
Product Overview
[(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate (CAS 477709-11-8), with molecular formula C12H10Cl2N4O2 and molecular weight 312.02 g/mol. IUPAC: [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate.
Chemical Property Profile of [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate
Property Insights of [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate
The XLogP value of 2.62122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate. The TPSA of 69.37 Ų falls within the moderate polarity range, balancing permeability and solubility for [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate 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 [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate?
The CAS number of [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate is 477709-11-8.
What is the molecular formula of [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate?
The molecular formula of [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate is C12H10Cl2N4O2.
What is the molecular weight of [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate?
The molecular weight of [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate is 312.02 g/mol.
Where can I buy [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate?
You can request a quote for [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-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-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 6-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.