5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide

C14H8Cl2F4N2O5S — CID 72949786

IUPAC5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide
SMILESNS(=O)(=O)NC(=O)c1cc(Cl)c(Oc2ccc(OC(F)(F)F)c(Cl)c2)cc1F
InChIInChI=1S/C14H8Cl2F4N2O5S/c15-8-3-6(1-2-11(8)27-14(18,19)20)26-12-5-10(17)7(4-9(12)16)13(23)22-28(21,24)25/h1-5H,(H,22,23)(H2,21,24,25)
InChIKeyFAHRALHWJZLDOT-UHFFFAOYSA-N
MW463.19 g/mol
LogP3.76
Rot. Bonds5

About 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide

5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide (PubChem CID 72949786) has the molecular formula C14H8Cl2F4N2O5S and a molecular weight of 463.19 g/mol. Its IUPAC name is 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide.

Molecular Properties

Compound Name5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide
PubChem CID72949786
Molecular FormulaC14H8Cl2F4N2O5S
Molecular Weight463.19 g/mol
Exact Mass461.95
IUPAC Name5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide
SMILESNS(=O)(=O)NC(=O)c1cc(Cl)c(Oc2ccc(OC(F)(F)F)c(Cl)c2)cc1F
InChIInChI=1S/C14H8Cl2F4N2O5S/c15-8-3-6(1-2-11(8)27-14(18,19)20)26-12-5-10(17)7(4-9(12)16)13(23)22-28(21,24)25/h1-5H,(H,22,23)(H2,21,24,25)
InChIKeyFAHRALHWJZLDOT-UHFFFAOYSA-N
XLogP3.76
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.19
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-methylphenyl) 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluorobenzoate
CID 58046317
4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-methylsulfonyl-5-(2-propoxy-3-pyridinyl)benzamide
CID 71610529
2-chloro-1-N-[[3-chloro-4-(trifluoromethoxy)phenyl]methyl]-5-fluoro-4-N-methylsulfonylbenzene-1,4-dicarboxamide
CID 155174188
5-[5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluorobenzoyl]pyrrolidine-2-carboxylic acid
CID 118648847
5-chloro-4-[[5-chloro-6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]oxy]-2-fluoro-N-methylsulfonylbenzamide
CID 58042409
N-[tert-butyl(dimethyl)-λ4-sulfanyl]-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-N-(cyclopropylsulfonimidoyl)-2,5-difluorobenzamide
CID 138554331
4-[4-chloro-3-(trifluoromethyl)phenoxy]-2-fluoro-5-methyl-N-methylsulfonylbenzamide
CID 56592533
1-[[5-chloro-4-(3-chloro-4-methoxyphenoxy)-2-fluorobenzoyl]amino]cyclopropane-1-carboxylic acid
CID 130184796
5-chloro-4-[[5-chloro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]-N-(cyclopropylsulfonimidoyl)-2-fluorobenzamide
CID 131964563
5-chloro-4-[[5-chloro-6-(2-methylpropoxy)-3-pyridinyl]oxy]-2-fluoro-N-(methylsulfamoyl)benzamide
CID 72949434
N-(3-acetyl-4-aminophenyl)-6-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-3-(trifluoromethyl)benzamide
CID 142516919
5-chloro-4-[[5-chloro-6-(2,2,3,3-tetrafluoropropoxy)-3-pyridinyl]oxy]-N-(dimethylsulfamoyl)-2-fluorobenzamide
CID 72950465

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide?
The IUPAC name of 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide (CID 72949786) is 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide.
What is the SMILES notation for 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide?
The canonical SMILES for 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide is NS(=O)(=O)NC(=O)c1cc(Cl)c(Oc2ccc(OC(F)(F)F)c(Cl)c2)cc1F.
What is the InChIKey of 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide?
The InChIKey is FAHRALHWJZLDOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2F4N2O5S/c15-8-3-6(1-2-11(8)27-14(18,19)20)26-12-5-10(17)7(4-9(12)16)13(23)22-28(21,24)25/h1-5H,(H,22,23)(H2,21,24,25).
What are the key properties of 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide?
5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide has a molecular weight of 463.19 g/mol, XLogP of 3.76, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-[3-chloro-4-(trifluoromethoxy)phenoxy]-2-fluoro-N-sulfamoylbenzamide is sourced from PubChem (CID 72949786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).