2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide

C18H14FN3O4S2 — CID 154859234

IUPAC2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide
SMILESNC(=O)c1csc(C(=O)Nc2ccccc2NS(=O)(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C18H14FN3O4S2/c19-12-5-7-13(8-6-12)28(25,26)22-15-4-2-1-3-14(15)21-18(24)16-9-11(10-27-16)17(20)23/h1-10,22H,(H2,20,23)(H,21,24)
InChIKeyKEVDNECNGOYIQC-UHFFFAOYSA-N
MW419.46 g/mol
LogP3.04
Rot. Bonds6

About 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide

2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide (PubChem CID 154859234) has the molecular formula C18H14FN3O4S2 and a molecular weight of 419.46 g/mol. Its IUPAC name is 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide
PubChem CID154859234
Molecular FormulaC18H14FN3O4S2
Molecular Weight419.46 g/mol
Exact Mass419.04
IUPAC Name2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide
SMILESNC(=O)c1csc(C(=O)Nc2ccccc2NS(=O)(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C18H14FN3O4S2/c19-12-5-7-13(8-6-12)28(25,26)22-15-4-2-1-3-14(15)21-18(24)16-9-11(10-27-16)17(20)23/h1-10,22H,(H2,20,23)(H,21,24)
InChIKeyKEVDNECNGOYIQC-UHFFFAOYSA-N
XLogP3.04
TPSA118.36 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.46
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]-1-benzothiophene-2-carboxamide
CID 55911688
3-fluoro-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]benzamide
CID 78805836
5-[[2-[(4-fluorophenyl)sulfonylamino]phenyl]sulfamoyl]thiophene-3-carboxylic acid
CID 25352849
2-fluoro-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]benzamide
CID 39948261
4-chloro-N-(2-chlorophenyl)-3-[(4-fluorophenyl)sulfonylamino]benzamide
CID 30879902
N-(3-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 2332033
N-(3-benzamidophenyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 55869973
3-(4-fluorophenyl)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]prop-2-enamide
CID 4105329
2-[(4-carbamoylphenyl)sulfonylamino]-N-(2-methoxyphenyl)benzamide
CID 18100692
4-[(4-fluorophenyl)sulfamoyl]benzamide
CID 2098781
2,4-difluoro-5-[[4-[(2-fluorophenyl)sulfamoyl]benzoyl]amino]benzamide
CID 56573065
N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2-sulfonamide
CID 8505367

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide?
The IUPAC name of 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide (CID 154859234) is 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide.
What is the SMILES notation for 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide?
The canonical SMILES for 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide is NC(=O)c1csc(C(=O)Nc2ccccc2NS(=O)(=O)c2ccc(F)cc2)c1.
What is the InChIKey of 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide?
The InChIKey is KEVDNECNGOYIQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN3O4S2/c19-12-5-7-13(8-6-12)28(25,26)22-15-4-2-1-3-14(15)21-18(24)16-9-11(10-27-16)17(20)23/h1-10,22H,(H2,20,23)(H,21,24).
What are the key properties of 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide?
2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide has a molecular weight of 419.46 g/mol, XLogP of 3.04, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2,4-dicarboxamide is sourced from PubChem (CID 154859234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).