N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide

C22H22N2O3S — CID 26731454

IUPACN-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H22N2O3S/c1-23(2)28(26,27)21-15-13-19(14-16-21)22(25)24(20-11-7-4-8-12-20)17-18-9-5-3-6-10-18/h3-16H,17H2,1-2H3
InChIKeyUWDHJZVXNLQWSZ-UHFFFAOYSA-N
MW394.50 g/mol
LogP3.78
Rot. Bonds6

About N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide

N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide (PubChem CID 26731454) has the molecular formula C22H22N2O3S and a molecular weight of 394.50 g/mol. Its IUPAC name is N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide.

Molecular Properties

Compound NameN-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide
PubChem CID26731454
Molecular FormulaC22H22N2O3S
Molecular Weight394.50 g/mol
Exact Mass394.14
IUPAC NameN-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H22N2O3S/c1-23(2)28(26,27)21-15-13-19(14-16-21)22(25)24(20-11-7-4-8-12-20)17-18-9-5-3-6-10-18/h3-16H,17H2,1-2H3
InChIKeyUWDHJZVXNLQWSZ-UHFFFAOYSA-N
XLogP3.78
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.50
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-4-chloro-N-phenylbenzamide
CID 20787883
N-benzyl-4-bromo-N-phenylbenzamide
CID 15817231
N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide
CID 9098551
methyl 4-[benzyl(phenyl)carbamoyl]benzoate
CID 24819418
N-benzyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-4-(dimethylsulfamoyl)benzamide
CID 41115361
N-(4-bromophenyl)-4-(dimethylsulfamoyl)-N-(pyridin-2-ylmethyl)benzamide
CID 60533673
4-(dimethylsulfamoyl)-N-ethyl-N-(2-phenylethyl)benzamide
CID 55588043
N-[2-(N-acetylanilino)ethyl]-4-(dimethylsulfamoyl)benzamide
CID 113057197
N-butyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
CID 8839615
N-benzyl-2-[[5-(dimethylsulfamoyl)-2-pyridinyl]sulfanyl]-N-phenylacetamide
CID 24571736
1-N-benzyl-1-N,4-N-diethyl-4-N-phenylbenzene-1,4-dicarboxamide
CID 109047506
N,N-dimethyl-4-[(N-phenylanilino)carbamoyl]benzenesulfonamide
CID 7760850

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide?
The IUPAC name of N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide (CID 26731454) is N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide.
What is the SMILES notation for N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide?
The canonical SMILES for N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide is CN(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide?
The InChIKey is UWDHJZVXNLQWSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3S/c1-23(2)28(26,27)21-15-13-19(14-16-21)22(25)24(20-11-7-4-8-12-20)17-18-9-5-3-6-10-18/h3-16H,17H2,1-2H3.
What are the key properties of N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide?
N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide has a molecular weight of 394.50 g/mol, XLogP of 3.78, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide is sourced from PubChem (CID 26731454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).