Benzofluor
TL;DR: Benzofluor (CAS 70025-85-3) is a chemical compound with molecular formula C10H12F3NO2S2 and molecular weight 299.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-ethylsulfanyl-2-(trifluoromethyl)phenyl]methanesulfonamide
Also Known As: Benzofluor, Benzofluor [ANSI], Benzofluor [ANSI:ISO], BENZOFLUOR [ISO], MBR 18337
| Molecular Formula | C10H12F3NO2S2 |
|---|---|
| Molecular Weight | 299.03 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.02615 |
| Heavy Atoms | 18 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 70025-85-3 |
|---|---|
| SMILES | CCSC1=CC(=C(C=C1)NS(=O)(=O)C)C(F)(F)F |
| InChIKey | IDFXUDGCYIGBDC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzofluor (CAS 70025-85-3), with molecular formula C10H12F3NO2S2 and molecular weight 299.03 g/mol. IUPAC: N-[4-ethylsulfanyl-2-(trifluoromethyl)phenyl]methanesulfonamide.
Chemical Property Profile of Benzofluor
Property Insights of Benzofluor
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzofluor. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzofluor. Following Lipinski's Rule of Five, Benzofluor has 1 hydrogen bond donor(s) and 7 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 Benzofluor?
The CAS number of Benzofluor is 70025-85-3.
What is the molecular formula of Benzofluor?
The molecular formula of Benzofluor is C10H12F3NO2S2.
What is the molecular weight of Benzofluor?
The molecular weight of Benzofluor is 299.03 g/mol.
Where can I buy Benzofluor?
You can request a quote for Benzofluor directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzofluor?
Yes, KEHONG BIO provides custom synthesis services for Benzofluor and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.