4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide

C20H14ClF3N2O3S — CID 92677411

IUPAC4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1Cl
InChIInChI=1S/C20H14ClF3N2O3S/c21-18-12-15(26-30(28,29)16-4-2-1-3-5-16)10-11-17(18)19(27)25-14-8-6-13(7-9-14)20(22,23)24/h1-12,26H,(H,25,27)
InChIKeyNHBQBGHEVCWXTE-UHFFFAOYSA-N
MW454.86 g/mol
LogP5.41
Rot. Bonds5

About 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide

4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide (PubChem CID 92677411) has the molecular formula C20H14ClF3N2O3S and a molecular weight of 454.86 g/mol. Its IUPAC name is 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
PubChem CID92677411
Molecular FormulaC20H14ClF3N2O3S
Molecular Weight454.86 g/mol
Exact Mass454.04
IUPAC Name4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1Cl
InChIInChI=1S/C20H14ClF3N2O3S/c21-18-12-15(26-30(28,29)16-4-2-1-3-5-16)10-11-17(18)19(27)25-14-8-6-13(7-9-14)20(22,23)24/h1-12,26H,(H,25,27)
InChIKeyNHBQBGHEVCWXTE-UHFFFAOYSA-N
XLogP5.41
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.86
LogP ≤ 55.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]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-(benzenesulfonamido)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]benzamide
CID 46763134
4-(benzenesulfonamido)-2-chloro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 99942022
4-(benzenesulfonamido)-2-chloro-N-(4-methylphenyl)benzamide
CID 43910172
4-(benzenesulfonamido)-2-chloro-N-[2-(trifluoromethyl)phenyl]benzamide
CID 92680505
N-[4-(benzenesulfonamido)phenyl]-2,4-dichlorobenzamide
CID 2311784
4-(benzenesulfonamido)-N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-2-chlorobenzamide
CID 43908153
5-(benzenesulfonamido)-2-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]benzamide
CID 28634197
2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2064029
4-(benzenesulfonamido)-2-chloro-N-[4-(naphthalen-1-ylsulfamoyl)phenyl]benzamide
CID 99943737
4-(benzenesulfonamido)-2-chloro-N-(2-ethylphenyl)benzamide
CID 28632195
4-(benzenesulfonamido)-2-chloro-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]benzamide
CID 99943631
4-(benzenesulfonamido)-2-chloro-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]benzamide
CID 43885917

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide (CID 92677411) is 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide is O=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1Cl.
What is the InChIKey of 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide?
The InChIKey is NHBQBGHEVCWXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClF3N2O3S/c21-18-12-15(26-30(28,29)16-4-2-1-3-5-16)10-11-17(18)19(27)25-14-8-6-13(7-9-14)20(22,23)24/h1-12,26H,(H,25,27).
What are the key properties of 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide?
4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide has a molecular weight of 454.86 g/mol, XLogP of 5.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 92677411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).