N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide
TL;DR: N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide (CAS 100341-45-5) is a chemical compound with molecular formula C16H8Cl2F6N2O3S and molecular weight 491.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2,5-dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl]carbamoyl]-2,6-difluorobenzamide
Also Known As: N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide, N-[[2,5-dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl]carbamoyl]-2,6-difluorobenzamide, Benzamide,N-[[[2,5-dichloro-4-[(1,1,2,2-tetrafluoroethyl)sulfinyl]phenyl]amino]carbonyl]-2,6-difluoro-, Benzamide, N-(((2,5-dichloro-4-((1,1,2,2- tetrafluoroethyl)sulfinyl)phenyl)amino)carbonyl)-2,6-difluoro-, Benzamide, N-[[[2,5-dichloro-4-[(1,1,2,2-tetrafluoroethyl)sulfinyl]phenyl]amino]carbonyl]-2,6-difluoro-
| Molecular Formula | C16H8Cl2F6N2O3S |
|---|---|
| Molecular Weight | 491.95 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 491.95367 |
| Heavy Atoms | 30 |
| Complexity | 667.0 |
Chemical Identifiers
| CAS Number | 100341-45-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=CC(=C(C=C2Cl)S(=O)C(C(F)F)(F)F)Cl)F |
| InChIKey | MNIKTEFCEWLGCQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide (CAS 100341-45-5), with molecular formula C16H8Cl2F6N2O3S and molecular weight 491.95 g/mol. IUPAC: N-[[2,5-dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl]carbamoyl]-2,6-difluorobenzamide.
Chemical Property Profile of N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide
Property Insights of N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide
The XLogP value of 5.0 indicates that N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide. Following Lipinski's Rule of Five, N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide has 2 hydrogen bond donor(s) and 10 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 N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide?
The CAS number of N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide is 100341-45-5.
What is the molecular formula of N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide?
The molecular formula of N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide is C16H8Cl2F6N2O3S.
What is the molecular weight of N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide?
The molecular weight of N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide is 491.95 g/mol.
Where can I buy N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide?
You can request a quote for N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((2,5-Dichloro-4-(1,1,2,2-tetrafluoroethylsulfinyl)phenyl)carbamoyl)-2,6-difluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.