3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide

C11H8Cl2N2O3S2 — CID 2807688

IUPAC3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide
SMILESNC(=O)c1sccc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C11H8Cl2N2O3S2/c12-7-2-1-6(5-8(7)13)20(17,18)15-9-3-4-19-10(9)11(14)16/h1-5,15H,(H2,14,16)
InChIKeyHFNCHMHRJZKVAL-UHFFFAOYSA-N
MW351.24 g/mol
LogP2.95
Rot. Bonds4

About 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide

3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide (PubChem CID 2807688) has the molecular formula C11H8Cl2N2O3S2 and a molecular weight of 351.24 g/mol. Its IUPAC name is 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide.

Molecular Properties

Compound Name3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide
PubChem CID2807688
Molecular FormulaC11H8Cl2N2O3S2
Molecular Weight351.24 g/mol
Exact Mass349.94
IUPAC Name3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide
SMILESNC(=O)c1sccc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C11H8Cl2N2O3S2/c12-7-2-1-6(5-8(7)13)20(17,18)15-9-3-4-19-10(9)11(14)16/h1-5,15H,(H2,14,16)
InChIKeyHFNCHMHRJZKVAL-UHFFFAOYSA-N
XLogP2.95
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.24
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dichloro-N-(2,4,5-trichlorophenyl)benzenesulfonamide
CID 4693261
methyl 3-[[3-chloro-4-(difluoromethoxy)phenyl]sulfonylamino]thiophene-2-carboxylate
CID 39828527
N-(2-amino-4-hydroxyphenyl)-3,4-dichlorobenzenesulfonamide
CID 107697982
3-[(4-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid
CID 16771674
2-[2-[(3,4-dichlorophenyl)sulfonylamino]phenyl]sulfanylacetamide
CID 9068061
5-[(3,4-dichlorophenyl)sulfonylamino]-2-fluorobenzamide
CID 39331681
N-(2-amino-4-bromophenyl)-3,4-dichlorobenzenesulfonamide
CID 43344070
3,4-dichlorobenzenesulfonohydrazide
CID 2735965
N-(4-chlorophenyl)-3-[(3-chlorophenyl)sulfonylamino]thiophene-2-carboxamide
CID 70120101
3,4-dichloro-N-(2-chloro-4-fluorophenyl)benzenesulfonamide
CID 26969900
methyl 3-[(2,5-dichlorophenyl)sulfonylamino]thiophene-2-carboxylate
CID 1358389
3,4-dichloro-N-(4-fluoro-2-hydroxyphenyl)benzenesulfonamide
CID 63677626

Frequently Asked Questions

What is the IUPAC name of 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide?
The IUPAC name of 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide (CID 2807688) is 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide.
What is the SMILES notation for 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide?
The canonical SMILES for 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide is NC(=O)c1sccc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide?
The InChIKey is HFNCHMHRJZKVAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2O3S2/c12-7-2-1-6(5-8(7)13)20(17,18)15-9-3-4-19-10(9)11(14)16/h1-5,15H,(H2,14,16).
What are the key properties of 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide?
3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide has a molecular weight of 351.24 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,4-dichlorophenyl)sulfonylamino]thiophene-2-carboxamide is sourced from PubChem (CID 2807688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).