2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide

C15H14Cl2N2O3S — CID 11211004

IUPAC2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide
SMILESCN(C)c1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C15H14Cl2N2O3S/c1-19(2)11-4-6-12(7-5-11)23(21,22)18-15(20)13-8-3-10(16)9-14(13)17/h3-9H,1-2H3,(H,18,20)
InChIKeyNAOFTUMOMQMLEM-UHFFFAOYSA-N
MW373.26 g/mol
LogP3.18
Rot. Bonds4

About 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide

2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide (PubChem CID 11211004) has the molecular formula C15H14Cl2N2O3S and a molecular weight of 373.26 g/mol. Its IUPAC name is 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide
PubChem CID11211004
Molecular FormulaC15H14Cl2N2O3S
Molecular Weight373.26 g/mol
Exact Mass372.01
IUPAC Name2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide
SMILESCN(C)c1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C15H14Cl2N2O3S/c1-19(2)11-4-6-12(7-5-11)23(21,22)18-15(20)13-8-3-10(16)9-14(13)17/h3-9H,1-2H3,(H,18,20)
InChIKeyNAOFTUMOMQMLEM-UHFFFAOYSA-N
XLogP3.18
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.26
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-Dichloro-N-phenyl-5-(1-piperidinylsulfonyl)benzamide
CID 1107106
2,4-dichloro-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide
CID 1014382
2,4-dichloro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 5157334
(E)-2-cyano-3-(2,4-dichlorophenyl)-N-(4-sulfamoylphenyl)prop-2-enamide
CID 1070933
4-[[(E)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]amino]benzenesulfonamide
CID 168278167
3-chloro-N-(4-sulfamoylphenyl)benzamide
CID 2455664
(E)-3-(2-chlorophenyl)-N-[4-(dimethylsulfamoyl)phenyl]prop-2-enamide
CID 2672927
4-chloro-N-(3-sulfamoylphenyl)benzamide
CID 3564294
4-chloro-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide
CID 4627354
2,4-dichloro-N-[(3-sulfamoylphenyl)carbamothioyl]benzamide
CID 71498311
N-[4-(benzenesulfonamido)phenyl]-2-chlorobenzamide
CID 2311681
2,5-dichloro-N-(4-sulfamoylphenyl)benzamide
CID 669678

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide?
The IUPAC name of 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide (CID 11211004) is 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide.
What is the SMILES notation for 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide?
The canonical SMILES for 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide is CN(C)c1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1.
What is the InChIKey of 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide?
The InChIKey is NAOFTUMOMQMLEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O3S/c1-19(2)11-4-6-12(7-5-11)23(21,22)18-15(20)13-8-3-10(16)9-14(13)17/h3-9H,1-2H3,(H,18,20).
What are the key properties of 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide?
2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide has a molecular weight of 373.26 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[4-(dimethylamino)phenyl]sulfonylbenzamide is sourced from PubChem (CID 11211004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).