2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide

C18H13F2N3O3S — CID 53257051

IUPAC2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1ccc(F)cc1F
InChIInChI=1S/C18H13F2N3O3S/c19-12-4-9-15(16(20)11-12)18(24)22-13-5-7-14(8-6-13)27(25,26)23-17-3-1-2-10-21-17/h1-11H,(H,21,23)(H,22,24)
InChIKeyDOGHZKAXRFTUNL-UHFFFAOYSA-N
MW389.38 g/mol
LogP3.41
Rot. Bonds5

About 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide

2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide (PubChem CID 53257051) has the molecular formula C18H13F2N3O3S and a molecular weight of 389.38 g/mol. Its IUPAC name is 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
PubChem CID53257051
Molecular FormulaC18H13F2N3O3S
Molecular Weight389.38 g/mol
Exact Mass389.06
IUPAC Name2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1ccc(F)cc1F
InChIInChI=1S/C18H13F2N3O3S/c19-12-4-9-15(16(20)11-12)18(24)22-13-5-7-14(8-6-13)27(25,26)23-17-3-1-2-10-21-17/h1-11H,(H,21,23)(H,22,24)
InChIKeyDOGHZKAXRFTUNL-UHFFFAOYSA-N
XLogP3.41
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.38
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2,4-difluorobenzamide
CID 4793489
2,4-difluoro-N-[4-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]phenyl]benzamide
CID 122315819
N-[4-(pyridin-2-ylsulfamoyl)phenyl]naphthalene-1-carboxamide
CID 19204277
2-ethoxy-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078176
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2,4-difluorobenzamide
CID 24636502
3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078174
3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 92677705
3,4-dimethyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078179
2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide
CID 51107830
2-fluoro-4-iodo-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 164618091
2-chloro-4-nitro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide;2,2,2-trifluoroacetic acid
CID 54759172
N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 725106

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide (CID 53257051) is 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1ccc(F)cc1F.
What is the InChIKey of 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The InChIKey is DOGHZKAXRFTUNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F2N3O3S/c19-12-4-9-15(16(20)11-12)18(24)22-13-5-7-14(8-6-13)27(25,26)23-17-3-1-2-10-21-17/h1-11H,(H,21,23)(H,22,24).
What are the key properties of 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide has a molecular weight of 389.38 g/mol, XLogP of 3.41, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 53257051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).