4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide

C20H17ClN2O4S — CID 9413651

IUPAC4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2)ccc1Cl
InChIInChI=1S/C20H17ClN2O4S/c1-22-28(25,26)19-13-14(7-12-18(19)21)20(24)23-15-8-10-17(11-9-15)27-16-5-3-2-4-6-16/h2-13,22H,1H3,(H,23,24)
InChIKeyNJURYWRJIUPKMY-UHFFFAOYSA-N
MW416.89 g/mol
LogP4.29
Rot. Bonds6

About 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide

4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide (PubChem CID 9413651) has the molecular formula C20H17ClN2O4S and a molecular weight of 416.89 g/mol. Its IUPAC name is 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide.

Molecular Properties

Compound Name4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide
PubChem CID9413651
Molecular FormulaC20H17ClN2O4S
Molecular Weight416.89 g/mol
Exact Mass416.06
IUPAC Name4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2)ccc1Cl
InChIInChI=1S/C20H17ClN2O4S/c1-22-28(25,26)19-13-14(7-12-18(19)21)20(24)23-15-8-10-17(11-9-15)27-16-5-3-2-4-6-16/h2-13,22H,1H3,(H,23,24)
InChIKeyNJURYWRJIUPKMY-UHFFFAOYSA-N
XLogP4.29
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.89
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)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-[(4-methoxyphenyl)sulfamoyl]-N-phenylbenzamide
CID 1102140
3-(benzylsulfamoyl)-4-chloro-N-(4-methoxyphenyl)benzamide
CID 24536240
2-chloro-N-methyl-5-[(4-phenoxybenzoyl)amino]benzamide
CID 55835370
3,4-dichloro-N-[4-[4-(2-phenylpropan-2-yl)phenoxy]phenyl]benzamide
CID 4507863
4-chloro-N-methyl-3-(methylsulfamoyl)benzamide
CID 19394
N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide
CID 11519607
1-N,3-N-bis(4-phenoxyphenyl)benzene-1,3-dicarboxamide
CID 3090014
(2-anilino-2-oxoethyl) 4-chloro-3-(methylsulfamoyl)benzoate
CID 7823722
4-chloro-3-(methylsulfamoyl)-N-phenylmethoxybenzamide
CID 9227450
4-tert-butyl-N-(4-phenoxyphenyl)benzamide
CID 675709
N-(3-chloro-4-methylphenyl)-4-phenoxybenzamide
CID 7900446
4-chloro-3-[(4-fluorophenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide
CID 27228973

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide?
The IUPAC name of 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide (CID 9413651) is 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide.
What is the SMILES notation for 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide?
The canonical SMILES for 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide is CNS(=O)(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2)ccc1Cl.
What is the InChIKey of 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide?
The InChIKey is NJURYWRJIUPKMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4S/c1-22-28(25,26)19-13-14(7-12-18(19)21)20(24)23-15-8-10-17(11-9-15)27-16-5-3-2-4-6-16/h2-13,22H,1H3,(H,23,24).
What are the key properties of 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide?
4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide has a molecular weight of 416.89 g/mol, XLogP of 4.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide is sourced from PubChem (CID 9413651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).