4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide

C19H20ClF3N2O4S — CID 24584146

IUPAC4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1cc(C(=O)NCc2ccc(OC(F)(F)F)cc2)ccc1Cl
InChIInChI=1S/C19H20ClF3N2O4S/c1-3-25(4-2)30(27,28)17-11-14(7-10-16(17)20)18(26)24-12-13-5-8-15(9-6-13)29-19(21,22)23/h5-11H,3-4,12H2,1-2H3,(H,24,26)
InChIKeyADTVXKOYWUYRIH-UHFFFAOYSA-N
MW464.89 g/mol
LogP4.20
Rot. Bonds8

About 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide

4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide (PubChem CID 24584146) has the molecular formula C19H20ClF3N2O4S and a molecular weight of 464.89 g/mol. Its IUPAC name is 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
PubChem CID24584146
Molecular FormulaC19H20ClF3N2O4S
Molecular Weight464.89 g/mol
Exact Mass464.08
IUPAC Name4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1cc(C(=O)NCc2ccc(OC(F)(F)F)cc2)ccc1Cl
InChIInChI=1S/C19H20ClF3N2O4S/c1-3-25(4-2)30(27,28)17-11-14(7-10-16(17)20)18(26)24-12-13-5-8-15(9-6-13)29-19(21,22)23/h5-11H,3-4,12H2,1-2H3,(H,24,26)
InChIKeyADTVXKOYWUYRIH-UHFFFAOYSA-N
XLogP4.20
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.89
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide 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-chloro-3-(diethylsulfamoyl)-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
CID 55902520
4-chloro-3-(dimethylsulfamoyl)-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide
CID 27052704
N-(2-benzamidoethyl)-4-chloro-3-(diethylsulfamoyl)benzamide
CID 38202373
4-chloro-3-(diethylsulfamoyl)benzoic acid
CID 767898
N-benzyl-3-(diethylsulfamoyl)-4-fluorobenzamide
CID 26534788
4-chloro-3-(diethylsulfamoyl)-N-(2-methyl-2-phenylpropyl)benzamide
CID 39698452
3-(ethylsulfonylamino)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
CID 24672381
4-chloro-3-(dimethylsulfamoyl)-N-[[4-[methyl(propan-2-yl)carbamoyl]phenyl]methyl]benzamide
CID 55611853
4-ethoxy-3-methoxy-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
CID 24575944
4-fluoro-3-morpholin-4-ylsulfonyl-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
CID 24646597
N-(4-tert-butylphenyl)-4-chloro-3-(diethylsulfamoyl)benzamide
CID 7914188
N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-4-(trifluoromethoxy)benzamide
CID 5134597

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide?
The IUPAC name of 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide (CID 24584146) is 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide.
What is the SMILES notation for 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide?
The canonical SMILES for 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide is CCN(CC)S(=O)(=O)c1cc(C(=O)NCc2ccc(OC(F)(F)F)cc2)ccc1Cl.
What is the InChIKey of 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide?
The InChIKey is ADTVXKOYWUYRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClF3N2O4S/c1-3-25(4-2)30(27,28)17-11-14(7-10-16(17)20)18(26)24-12-13-5-8-15(9-6-13)29-19(21,22)23/h5-11H,3-4,12H2,1-2H3,(H,24,26).
What are the key properties of 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide?
4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide has a molecular weight of 464.89 g/mol, XLogP of 4.20, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(diethylsulfamoyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide is sourced from PubChem (CID 24584146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).