N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide

C17H12F2N2O4S — CID 31582051

IUPACN-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)c1ccco1
InChIInChI=1S/C17H12F2N2O4S/c18-14-8-7-13(10-15(14)19)26(23,24)21-12-5-3-11(4-6-12)20-17(22)16-2-1-9-25-16/h1-10,21H,(H,20,22)
InChIKeyLPFHDKYEHPLKEY-UHFFFAOYSA-N
MW378.36 g/mol
LogP3.61
Rot. Bonds5

About N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide

N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide (PubChem CID 31582051) has the molecular formula C17H12F2N2O4S and a molecular weight of 378.36 g/mol. Its IUPAC name is N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide
PubChem CID31582051
Molecular FormulaC17H12F2N2O4S
Molecular Weight378.36 g/mol
Exact Mass378.05
IUPAC NameN-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)c1ccco1
InChIInChI=1S/C17H12F2N2O4S/c18-14-8-7-13(10-15(14)19)26(23,24)21-12-5-3-11(4-6-12)20-17(22)16-2-1-9-25-16/h1-10,21H,(H,20,22)
InChIKeyLPFHDKYEHPLKEY-UHFFFAOYSA-N
XLogP3.61
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.36
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[[4-[(4-chlorophenyl)sulfamoyl]benzoyl]amino]phenyl]furan-2-carboxamide
CID 42014553
N-[4-[[4-[(4-fluorophenyl)sulfamoyl]benzoyl]amino]phenyl]furan-2-carboxamide
CID 42014548
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2-fluorobenzamide
CID 55349327
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2,5-difluorobenzamide
CID 55376849
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2,4-difluorobenzamide
CID 24636502
N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide
CID 2374061
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-(4-fluorophenyl)furan-2-carboxamide
CID 531893
N-[3-[(4-sulfamoylphenyl)sulfonylamino]phenyl]furan-2-carboxamide
CID 18206661
N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]furan-2-carboxamide
CID 648040
3,4-difluoro-N-[4-(methylamino)phenyl]benzenesulfonamide
CID 43403537
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2-(4-fluorophenyl)acetamide
CID 51549535

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide (CID 31582051) is N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide is O=C(Nc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)c1ccco1.
What is the InChIKey of N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide?
The InChIKey is LPFHDKYEHPLKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F2N2O4S/c18-14-8-7-13(10-15(14)19)26(23,24)21-12-5-3-11(4-6-12)20-17(22)16-2-1-9-25-16/h1-10,21H,(H,20,22).
What are the key properties of N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide?
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide has a molecular weight of 378.36 g/mol, XLogP of 3.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 31582051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).