3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide

C12H13N3O3S2 — CID 4030304

IUPAC3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2nccs2)c1
InChIInChI=1S/C12H13N3O3S2/c1-15(2)20(17,18)10-5-3-4-9(8-10)11(16)14-12-13-6-7-19-12/h3-8H,1-2H3,(H,13,14,16)
InChIKeyZQDRFDLWYRFTEI-UHFFFAOYSA-N
MW311.39 g/mol
LogP1.65
Rot. Bonds4

About 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide

3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 4030304) has the molecular formula C12H13N3O3S2 and a molecular weight of 311.39 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
PubChem CID4030304
Molecular FormulaC12H13N3O3S2
Molecular Weight311.39 g/mol
Exact Mass311.04
IUPAC Name3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2nccs2)c1
InChIInChI=1S/C12H13N3O3S2/c1-15(2)20(17,18)10-5-3-4-9(8-10)11(16)14-12-13-6-7-19-12/h3-8H,1-2H3,(H,13,14,16)
InChIKeyZQDRFDLWYRFTEI-UHFFFAOYSA-N
XLogP1.65
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-yl)phenyl]benzamide
CID 8795483
2-chloro-5-(dimethylsulfamoyl)-N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 55602065
3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
CID 166188646
3-[benzyl-(2-methoxyphenyl)sulfamoyl]-N-(1,3-thiazol-2-yl)benzamide
CID 2079702
3-hydroxy-N-(1,3-thiazol-2-yl)benzamide
CID 17362164
3-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]-N-(1,3-thiazol-2-yl)benzamide
CID 27257413
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(dimethylsulfamoyl)benzamide
CID 32864912
N-(1,3-thiazol-2-yl)-3-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 2376546
3-(4-phenylpiperazin-1-yl)sulfonyl-N-(1,3-thiazol-2-yl)benzamide
CID 2117884
N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
N-(6-bromo-3-pyridinyl)-3-(dimethylsulfamoyl)benzamide
CID 110614688
N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(dimethylsulfamoyl)benzamide
CID 17439101

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide (CID 4030304) is 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)Nc2nccs2)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is ZQDRFDLWYRFTEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3S2/c1-15(2)20(17,18)10-5-3-4-9(8-10)11(16)14-12-13-6-7-19-12/h3-8H,1-2H3,(H,13,14,16).
What are the key properties of 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide?
3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 311.39 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 4030304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).