4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide

C16H16N6O3S — CID 8753105

IUPAC4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)Nc2cccc(-n3cnnn3)c2)cc1
InChIInChI=1S/C16H16N6O3S/c1-21(2)26(24,25)15-8-6-12(7-9-15)16(23)18-13-4-3-5-14(10-13)22-11-17-19-20-22/h3-11H,1-2H3,(H,18,23)
InChIKeyIPJJABLRCFFTFQ-UHFFFAOYSA-N
MW372.41 g/mol
LogP1.16
Rot. Bonds5

About 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide

4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide (PubChem CID 8753105) has the molecular formula C16H16N6O3S and a molecular weight of 372.41 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide
PubChem CID8753105
Molecular FormulaC16H16N6O3S
Molecular Weight372.41 g/mol
Exact Mass372.10
IUPAC Name4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)Nc2cccc(-n3cnnn3)c2)cc1
InChIInChI=1S/C16H16N6O3S/c1-21(2)26(24,25)15-8-6-12(7-9-15)16(23)18-13-4-3-5-14(10-13)22-11-17-19-20-22/h3-11H,1-2H3,(H,18,23)
InChIKeyIPJJABLRCFFTFQ-UHFFFAOYSA-N
XLogP1.16
TPSA110.08 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.41
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-(dimethylsulfamoyl)phenyl]-3-(tetrazol-1-yl)benzamide
CID 9494536
4-amino-N-[3-(tetrazol-1-yl)phenyl]benzamide
CID 43702822
2-[(4-cyanophenyl)sulfonyl-methylamino]-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 24664110
N-(3-acetylphenyl)-3-(tetrazol-1-yl)benzamide
CID 862153
4-(difluoromethylsulfanyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide
CID 24617889
methyl 3-[[4-(dimethylsulfamoyl)benzoyl]amino]benzoate
CID 2676546
2-ethyl-N-[3-(tetrazol-1-yl)phenyl]butanamide
CID 47097708
4-[cyclohexyl(methyl)sulfamoyl]-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide
CID 55676850
5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide
CID 63860092
N-(3-pyrazol-1-ylphenyl)-3-(tetrazol-1-yl)benzamide
CID 55700294
N-[3-(dimethylsulfamoyl)phenyl]-4-methylsulfonylbenzamide
CID 9093665
2-chloro-N-[3-(tetrazol-1-yl)phenyl]pyridine-4-carboxamide
CID 32696269

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide (CID 8753105) is 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide is CN(C)S(=O)(=O)c1ccc(C(=O)Nc2cccc(-n3cnnn3)c2)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide?
The InChIKey is IPJJABLRCFFTFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N6O3S/c1-21(2)26(24,25)15-8-6-12(7-9-15)16(23)18-13-4-3-5-14(10-13)22-11-17-19-20-22/h3-11H,1-2H3,(H,18,23).
What are the key properties of 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide?
4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide has a molecular weight of 372.41 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide is sourced from PubChem (CID 8753105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).