3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole
TL;DR: 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole (CAS 13658-71-4) is a chemical compound with molecular formula C15H14N2O2S and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-1-naphthalen-2-ylsulfonylpyrazole
Also Known As: 3,5-dimethyl-1-naphthalen-2-ylsulfonylpyrazole, 3,5-dimethyl-1-(2-naphthylsulfonyl)-1H-pyrazole, 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole, BAS 01173479, 3,5-dimethyl-1-(naphthalen-2-ylsulfonyl)-1H-pyrazole
| Molecular Formula | C15H14N2O2S |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.0776 |
| Heavy Atoms | 20 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 13658-71-4 |
|---|---|
| SMILES | CC1=CC(=NN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C |
| InChIKey | HOWUKVOTBCIKAY-UHFFFAOYSA-N |
Product Overview
3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole (CAS 13658-71-4), with molecular formula C15H14N2O2S and molecular weight 286.08 g/mol. IUPAC: 3,5-dimethyl-1-naphthalen-2-ylsulfonylpyrazole.
Chemical Property Profile of 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole
Property Insights of 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole
The XLogP value of 3.5 indicates that 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole. Following Lipinski's Rule of Five, 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole 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 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole?
The CAS number of 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole is 13658-71-4.
What is the molecular formula of 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole?
The molecular formula of 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole is C15H14N2O2S.
What is the molecular weight of 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole?
The molecular weight of 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole is 286.08 g/mol.
Where can I buy 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole?
You can request a quote for 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-1-(naphthalene-2-sulfonyl)-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.