4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide

C19H15FN2O3S — CID 68946536

IUPAC4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide
SMILESNC(=O)c1ccc(NS(=O)(=O)c2cccc(-c3ccc(F)cc3)c2)cc1
InChIInChI=1S/C19H15FN2O3S/c20-16-8-4-13(5-9-16)15-2-1-3-18(12-15)26(24,25)22-17-10-6-14(7-11-17)19(21)23/h1-12,22H,(H2,21,23)
InChIKeyAMRKZMVTSMASRG-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.39
Rot. Bonds5

About 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide

4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide (PubChem CID 68946536) has the molecular formula C19H15FN2O3S and a molecular weight of 370.41 g/mol. Its IUPAC name is 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide.

Molecular Properties

Compound Name4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide
PubChem CID68946536
Molecular FormulaC19H15FN2O3S
Molecular Weight370.41 g/mol
Exact Mass370.08
IUPAC Name4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide
SMILESNC(=O)c1ccc(NS(=O)(=O)c2cccc(-c3ccc(F)cc3)c2)cc1
InChIInChI=1S/C19H15FN2O3S/c20-16-8-4-13(5-9-16)15-2-1-3-18(12-15)26(24,25)22-17-10-6-14(7-11-17)19(21)23/h1-12,22H,(H2,21,23)
InChIKeyAMRKZMVTSMASRG-UHFFFAOYSA-N
XLogP3.39
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide?
The IUPAC name of 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide (CID 68946536) is 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide.
What is the SMILES notation for 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide?
The canonical SMILES for 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide is NC(=O)c1ccc(NS(=O)(=O)c2cccc(-c3ccc(F)cc3)c2)cc1.
What is the InChIKey of 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide?
The InChIKey is AMRKZMVTSMASRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O3S/c20-16-8-4-13(5-9-16)15-2-1-3-18(12-15)26(24,25)22-17-10-6-14(7-11-17)19(21)23/h1-12,22H,(H2,21,23).
What are the key properties of 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide?
4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide has a molecular weight of 370.41 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzamide is sourced from PubChem (CID 68946536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).