2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide

C20H12Cl4N2O4S — CID 5064055

IUPAC2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C20H12Cl4N2O4S/c21-11-1-7-15(17(23)9-11)19(27)25-13-3-5-14(6-4-13)31(29,30)26-20(28)16-8-2-12(22)10-18(16)24/h1-10H,(H,25,27)(H,26,28)
InChIKeyMAAKXRYWTFKSCA-UHFFFAOYSA-N
MW518.21 g/mol
LogP5.67
Rot. Bonds5

About 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide

2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide (PubChem CID 5064055) has the molecular formula C20H12Cl4N2O4S and a molecular weight of 518.21 g/mol. Its IUPAC name is 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide
PubChem CID5064055
Molecular FormulaC20H12Cl4N2O4S
Molecular Weight518.21 g/mol
Exact Mass515.93
IUPAC Name2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C20H12Cl4N2O4S/c21-11-1-7-15(17(23)9-11)19(27)25-13-3-5-14(6-4-13)31(29,30)26-20(28)16-8-2-12(22)10-18(16)24/h1-10H,(H,25,27)(H,26,28)
InChIKeyMAAKXRYWTFKSCA-UHFFFAOYSA-N
XLogP5.67
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.21
LogP ≤ 55.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]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

2,4-dichloro-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]benzamide
CID 1053036
N-[4-(benzenesulfonamido)phenyl]-2,4-dichlorobenzamide
CID 2311784
2,4-dichloro-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 4778992
2,4-dichloro-N-(4-methylsulfanylphenyl)sulfonylbenzamide
CID 11474329
(2S)-2-[[4-[(2,4-dichlorobenzoyl)amino]phenyl]sulfonylamino]-3-methylbutanoic acid
CID 69206535
N-(4-acetamidophenyl)-2,4-dichlorobenzamide
CID 786004
N-[4-(azepan-1-ylsulfonyl)phenyl]-2,4-dichlorobenzamide
CID 1010211
2,4-dichloro-N-(4-sulfanylphenyl)benzamide
CID 143459356
2-chloro-N-[4-[(2,4-dichlorophenyl)sulfamoyl]phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 43875630
(2S)-2-[[4-[(2,4-dichlorobenzoyl)amino]phenyl]sulfonylamino]-3-phenylpropanoic acid
CID 69208285
4-(benzenesulfonamido)-2-chloro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 99942022
2,4-dichloro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
CID 9203694

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide (CID 5064055) is 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide?
The InChIKey is MAAKXRYWTFKSCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12Cl4N2O4S/c21-11-1-7-15(17(23)9-11)19(27)25-13-3-5-14(6-4-13)31(29,30)26-20(28)16-8-2-12(22)10-18(16)24/h1-10H,(H,25,27)(H,26,28).
What are the key properties of 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide?
2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide has a molecular weight of 518.21 g/mol, XLogP of 5.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[4-[(2,4-dichlorobenzoyl)sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 5064055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).