4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide

C11H9BrN2O3S2 — CID 6503878

IUPAC4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide
SMILESNC(=O)c1cc(S(=O)(=O)Nc2ccc(Br)cc2)cs1
InChIInChI=1S/C11H9BrN2O3S2/c12-7-1-3-8(4-2-7)14-19(16,17)9-5-10(11(13)15)18-6-9/h1-6,14H,(H2,13,15)
InChIKeyQSOWZCBSMGBJSK-UHFFFAOYSA-N
MW361.24 g/mol
LogP2.41
Rot. Bonds4

About 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide

4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide (PubChem CID 6503878) has the molecular formula C11H9BrN2O3S2 and a molecular weight of 361.24 g/mol. Its IUPAC name is 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide
PubChem CID6503878
Molecular FormulaC11H9BrN2O3S2
Molecular Weight361.24 g/mol
Exact Mass359.92
IUPAC Name4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide
SMILESNC(=O)c1cc(S(=O)(=O)Nc2ccc(Br)cc2)cs1
InChIInChI=1S/C11H9BrN2O3S2/c12-7-1-3-8(4-2-7)14-19(16,17)9-5-10(11(13)15)18-6-9/h1-6,14H,(H2,13,15)
InChIKeyQSOWZCBSMGBJSK-UHFFFAOYSA-N
XLogP2.41
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.24
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-acetylphenyl)sulfamoyl]thiophene-2-carboxamide
CID 6503881
4-[(4-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide
CID 6486042
4-[(3,4-dimethoxyphenyl)sulfamoyl]thiophene-2-carboxamide
CID 20900799
4-[(2,4-dibromophenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 61062715
4-[(4-bromothiophen-2-yl)sulfonylamino]benzamide
CID 110678469
4-[(4-cyanophenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 61063606
(2R)-2-[(5-carbamoylthiophen-3-yl)sulfonylamino]propanoic acid
CID 40634872
4-bromo-N-(4-hydroxyphenyl)benzenesulfonamide
CID 875203
4-[(2,6-dibromo-4-methylphenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 63616649
4-[[(1R)-1-(4-bromophenyl)ethyl]sulfamoyl]thiophene-2-carboxylic acid
CID 81356153
N-(4-bromophenyl)-4-iodobenzenesulfonamide
CID 990484
N-(4-bromophenyl)-5-chloro-6-hydrazinylpyridine-3-sulfonamide
CID 64607594

Frequently Asked Questions

What is the IUPAC name of 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide?
The IUPAC name of 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide (CID 6503878) is 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide.
What is the SMILES notation for 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide?
The canonical SMILES for 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide is NC(=O)c1cc(S(=O)(=O)Nc2ccc(Br)cc2)cs1.
What is the InChIKey of 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide?
The InChIKey is QSOWZCBSMGBJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN2O3S2/c12-7-1-3-8(4-2-7)14-19(16,17)9-5-10(11(13)15)18-6-9/h1-6,14H,(H2,13,15).
What are the key properties of 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide?
4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide has a molecular weight of 361.24 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-bromophenyl)sulfamoyl]thiophene-2-carboxamide is sourced from PubChem (CID 6503878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).