N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide

C15H15BrN2O3S — CID 2221562

IUPACN-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc(Br)c2)c1
InChIInChI=1S/C15H15BrN2O3S/c1-18(2)22(20,21)14-8-3-5-11(9-14)15(19)17-13-7-4-6-12(16)10-13/h3-10H,1-2H3,(H,17,19)
InChIKeyNMMKXGVVESOVAB-UHFFFAOYSA-N
MW383.27 g/mol
LogP2.95
Rot. Bonds4

About N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide

N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide (PubChem CID 2221562) has the molecular formula C15H15BrN2O3S and a molecular weight of 383.27 g/mol. Its IUPAC name is N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide
PubChem CID2221562
Molecular FormulaC15H15BrN2O3S
Molecular Weight383.27 g/mol
Exact Mass382.00
IUPAC NameN-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc(Br)c2)c1
InChIInChI=1S/C15H15BrN2O3S/c1-18(2)22(20,21)14-8-3-5-11(9-14)15(19)17-13-7-4-6-12(16)10-13/h3-10H,1-2H3,(H,17,19)
InChIKeyNMMKXGVVESOVAB-UHFFFAOYSA-N
XLogP2.95
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.27
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-3-(dimethylsulfamoyl)benzamide
CID 100625475
N-(3-bromophenyl)-3-propan-2-ylsulfonylbenzamide
CID 41148003
3-(dimethylsulfamoyl)-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide
CID 100624777
N-(6-bromo-3-pyridinyl)-3-(dimethylsulfamoyl)benzamide
CID 110614688
N-[4-(dimethylamino)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 110356126
3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide
CID 110425651
N-[3-(dimethylsulfamoyl)phenyl]-3-nitrobenzamide
CID 9093681
N-(3-bromophenyl)-5-(dimethylsulfamoyl)furan-3-carboxamide
CID 71909683
N-[3-(dimethylsulfamoyl)phenyl]-4-methylsulfonylbenzamide
CID 9093665
2-bromo-N-[3-(dimethylsulfamoyl)phenyl]furan-3-carboxamide
CID 106852841
3-benzamido-N-(3-bromophenyl)benzamide
CID 1304486
N-(3-bromophenyl)-3-[ethylsulfonyl(methyl)amino]benzamide
CID 100785831

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide?
The IUPAC name of N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide (CID 2221562) is N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide.
What is the SMILES notation for N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide?
The canonical SMILES for N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc(Br)c2)c1.
What is the InChIKey of N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide?
The InChIKey is NMMKXGVVESOVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O3S/c1-18(2)22(20,21)14-8-3-5-11(9-14)15(19)17-13-7-4-6-12(16)10-13/h3-10H,1-2H3,(H,17,19).
What are the key properties of N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide?
N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide has a molecular weight of 383.27 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide is sourced from PubChem (CID 2221562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).