2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide
TL;DR: 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide (CAS 100279-02-5) is a chemical compound with molecular formula C17H12F6N2O2S and molecular weight 422.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-difluoro-N-[[2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl]carbamoyl]benzamide
Also Known As: 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide, 2,6-difluoro-N-[[2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl]carbamoyl]benzamide, 1-(2,6-Difluorobenzoyl)-3-[2-methyl-4-[(1,1,2,2-tetrafluoroethyl)thio]phenyl]urea, 1-(2,6-difluorobenzoyl)-3-{2-methyl-4-[(1,1,2,2-tetrafluoroethyl)sulfanyl]phenyl}urea, 2,6-Difluoro-N-({2-methyl-4-[(1,1,2,2-tetrafluoroethyl)sulfanyl]phenyl}carbamoyl)benzamide
| Molecular Formula | C17H12F6N2O2S |
|---|---|
| Molecular Weight | 422.05 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.05237 |
| Heavy Atoms | 28 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 100279-02-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)SC(C(F)F)(F)F)NC(=O)NC(=O)C2=C(C=CC=C2F)F |
| InChIKey | UZEFSCUGGLZEIR-UHFFFAOYSA-N |
Product Overview
2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide (CAS 100279-02-5), with molecular formula C17H12F6N2O2S and molecular weight 422.05 g/mol. IUPAC: 2,6-difluoro-N-[[2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl]carbamoyl]benzamide.
Chemical Property Profile of 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide
Property Insights of 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide
The XLogP value of 5.6 indicates that 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide. Following Lipinski's Rule of Five, 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide?
The CAS number of 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide is 100279-02-5.
What is the molecular formula of 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide?
The molecular formula of 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide is C17H12F6N2O2S.
What is the molecular weight of 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide?
The molecular weight of 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide is 422.05 g/mol.
Where can I buy 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide?
You can request a quote for 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Difluoro-N-((2-methyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)phenyl)carbamoyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.