Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate
TL;DR: Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate (CAS 647825-43-2) is a chemical compound with molecular formula C10H10ClN3O3S and molecular weight 287.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate
Also Known As: pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate, 3-pyridyl 5-chloro-1,3-dimethyl-1H-pyrazole-4-sulphonate, 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyloxypyridine, 3-pyridyl 5-chloro-1,3-dimethyl-1h-pyrazole-4-sulfonate
| Molecular Formula | C10H10ClN3O3S |
|---|---|
| Molecular Weight | 287.01 g/mol |
| LogP | 1.54462 |
| Topological Polar Surface Area | 74.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.01315 |
| Heavy Atoms | 18 |
| Complexity | 667.1764 |
Chemical Identifiers
| CAS Number | 647825-43-2 |
|---|---|
| SMILES | CC1=NN(C(=C1S(=O)(=O)OC2=CN=CC=C2)Cl)C |
Product Overview
Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate (CAS 647825-43-2), with molecular formula C10H10ClN3O3S and molecular weight 287.01 g/mol. IUPAC: pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate.
Chemical Property Profile of Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate
Property Insights of Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate
The XLogP value of 1.54462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate. The TPSA of 74.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate. Following Lipinski's Rule of Five, Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate 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 Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate?
The CAS number of Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate is 647825-43-2.
What is the molecular formula of Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate?
The molecular formula of Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate is C10H10ClN3O3S.
What is the molecular weight of Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate?
The molecular weight of Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate is 287.01 g/mol.
Where can I buy Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate?
You can request a quote for Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for Pyridin-3-yl 5-chloro-1,3-dimethylpyrazole-4-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.