5W-0261
TL;DR: 5W-0261 (CAS 866039-87-4) is a chemical compound with molecular formula C13H15FN2O4S and molecular weight 314.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)sulfonyl-4-(2-hydroxyethyl)-2,5-dimethylpyrazol-3-one
Also Known As: 5W-0261, 1-[(4-fluorophenyl)sulfonyl]-4-(2-hydroxyethyl)-2,5-dimethyl-1,2-dihydro-3H-pyrazol-3-one, 1-(4-fluorophenyl)sulfonyl-4-(2-hydroxyethyl)-2,5-dimethylpyrazol-3-one, 1-(4-fluorobenzenesulfonyl)-4-(2-hydroxyethyl)-2,5-dimethyl-2,3-dihydro-1H-pyrazol-3-one
| Molecular Formula | C13H15FN2O4S |
|---|---|
| Molecular Weight | 314.07 g/mol |
| LogP | 0.40612 |
| Topological Polar Surface Area | 81.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.07367 |
| Heavy Atoms | 21 |
| Complexity | 819.09155 |
Chemical Identifiers
| CAS Number | 866039-87-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1S(=O)(=O)C2=CC=C(C=C2)F)C)CCO |
Product Overview
5W-0261 (CAS 866039-87-4), with molecular formula C13H15FN2O4S and molecular weight 314.07 g/mol. IUPAC: 1-(4-fluorophenyl)sulfonyl-4-(2-hydroxyethyl)-2,5-dimethylpyrazol-3-one.
Chemical Property Profile of 5W-0261
Property Insights of 5W-0261
The XLogP value of 0.40612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5W-0261. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5W-0261. Following Lipinski's Rule of Five, 5W-0261 has 1 hydrogen bond donor(s) and 4 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 5W-0261?
The CAS number of 5W-0261 is 866039-87-4.
What is the molecular formula of 5W-0261?
The molecular formula of 5W-0261 is C13H15FN2O4S.
What is the molecular weight of 5W-0261?
The molecular weight of 5W-0261 is 314.07 g/mol.
Where can I buy 5W-0261?
You can request a quote for 5W-0261 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5W-0261?
Yes, KEHONG BIO provides custom synthesis services for 5W-0261 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.