1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride
TL;DR: 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride (CAS 943152-92-9) is a chemical compound with molecular formula C6H7ClF2N2O2S and molecular weight 243.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonyl chloride
Also Known As: 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride, 1-Difluoromethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride, 1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonyl chloride, 3911AF, BAS 13537627
| Molecular Formula | C6H7ClF2N2O2S |
|---|---|
| Molecular Weight | 243.99 g/mol |
| LogP | 1.82254 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.98848 |
| Heavy Atoms | 14 |
| Complexity | 454.64172 |
Chemical Identifiers
| CAS Number | 943152-92-9 |
|---|---|
| SMILES | CC1=C(C(=NN1C(F)F)C)S(=O)(=O)Cl |
Product Overview
1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride (CAS 943152-92-9), with molecular formula C6H7ClF2N2O2S and molecular weight 243.99 g/mol. IUPAC: 1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonyl chloride.
Chemical Property Profile of 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride
Property Insights of 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride
The XLogP value of 1.82254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride. With a topological polar surface area (TPSA) of 51.96 Ų, 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride has 0 hydrogen bond donor(s) and 3 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 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride?
The CAS number of 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride is 943152-92-9.
What is the molecular formula of 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride?
The molecular formula of 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride is C6H7ClF2N2O2S.
What is the molecular weight of 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride?
The molecular weight of 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride is 243.99 g/mol.
Where can I buy 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride?
You can request a quote for 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.