4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide

C16H14N4O3S2 — CID 55984008

IUPAC4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide
SMILESCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(-c3csnn3)cc2)cc1
InChIInChI=1S/C16H14N4O3S2/c1-17-25(22,23)14-8-4-12(5-9-14)16(21)18-13-6-2-11(3-7-13)15-10-24-20-19-15/h2-10,17H,1H3,(H,18,21)
InChIKeyIVVFPIXJHFKNHL-UHFFFAOYSA-N
MW374.45 g/mol
LogP2.37
Rot. Bonds5

About 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide

4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide (PubChem CID 55984008) has the molecular formula C16H14N4O3S2 and a molecular weight of 374.45 g/mol. Its IUPAC name is 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide
PubChem CID55984008
Molecular FormulaC16H14N4O3S2
Molecular Weight374.45 g/mol
Exact Mass374.05
IUPAC Name4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide
SMILESCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(-c3csnn3)cc2)cc1
InChIInChI=1S/C16H14N4O3S2/c1-17-25(22,23)14-8-4-12(5-9-14)16(21)18-13-6-2-11(3-7-13)15-10-24-20-19-15/h2-10,17H,1H3,(H,18,21)
InChIKeyIVVFPIXJHFKNHL-UHFFFAOYSA-N
XLogP2.37
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.45
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(methylsulfamoyl)phenyl]-1,2-thiazole-4-carboxamide
CID 141468396
N-(4-bromophenyl)-4-(methylsulfamoyl)benzamide
CID 35436567
N-[4-(diethylamino)phenyl]-4-(methylsulfamoyl)benzamide
CID 27229396
4-[(1,3-dioxoisoindol-2-yl)methyl]-N-[4-(thiadiazol-4-yl)phenyl]benzamide
CID 55985027
N-[4-chloro-3-[[4-(thiadiazol-4-yl)benzoyl]amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 16730716
N-[4-[2-(cyclopropylmethylamino)cyclopropyl]phenyl]-4-(thiadiazol-4-yl)benzamide
CID 71260560
N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide
CID 7488144
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815
N-[2-[[4-(thiadiazol-4-yl)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide
CID 154874344
N-(3-chlorophenyl)-4-(methylsulfamoyl)benzamide
CID 34742954
N-(4-cyclopentyloxyphenyl)-4-(methylsulfamoyl)benzamide
CID 38455287
3-amino-N-[4-(methylsulfamoyl)phenyl]benzamide
CID 43710565

Frequently Asked Questions

What is the IUPAC name of 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide?
The IUPAC name of 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide (CID 55984008) is 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide.
What is the SMILES notation for 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide?
The canonical SMILES for 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide is CNS(=O)(=O)c1ccc(C(=O)Nc2ccc(-c3csnn3)cc2)cc1.
What is the InChIKey of 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide?
The InChIKey is IVVFPIXJHFKNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O3S2/c1-17-25(22,23)14-8-4-12(5-9-14)16(21)18-13-6-2-11(3-7-13)15-10-24-20-19-15/h2-10,17H,1H3,(H,18,21).
What are the key properties of 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide?
4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide has a molecular weight of 374.45 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylsulfamoyl)-N-[4-(thiadiazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 55984008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).