3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide

C19H15FN2O4S — CID 992247

IUPAC3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccccc1O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1
InChIInChI=1S/C19H15FN2O4S/c20-14-8-10-15(11-9-14)22-27(25,26)16-5-3-4-13(12-16)19(24)21-17-6-1-2-7-18(17)23/h1-12,22-23H,(H,21,24)
InChIKeyOICSOIZQPJLUGX-UHFFFAOYSA-N
MW386.40 g/mol
LogP3.58
Rot. Bonds5

About 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide

3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide (PubChem CID 992247) has the molecular formula C19H15FN2O4S and a molecular weight of 386.40 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide
PubChem CID992247
Molecular FormulaC19H15FN2O4S
Molecular Weight386.40 g/mol
Exact Mass386.07
IUPAC Name3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccccc1O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1
InChIInChI=1S/C19H15FN2O4S/c20-14-8-10-15(11-9-14)22-27(25,26)16-5-3-4-13(12-16)19(24)21-17-6-1-2-7-18(17)23/h1-12,22-23H,(H,21,24)
InChIKeyOICSOIZQPJLUGX-UHFFFAOYSA-N
XLogP3.58
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.40
LogP ≤ 53.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(3-(4-fluorobenzenesulfonamido)-4-hydroxyphenyl)-(1,1'-biphenyl)-4-carboxamide
CID 138005721
N-(2-hydroxyphenyl)-2-[[2-[(2-hydroxyphenyl)carbamoyl]phenyl]diselanyl]benzamide
CID 13673571
N-(2-hydroxy-5-sulfamoylphenyl)-4-nitrobenzamide
CID 4280205
N-(3-Hydroxy-phenyl)-3-(3-hydroxy-phenylsulfamoyl)-benzamide
CID 1069242
N-[5-[(2-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2,4-difluorobenzamide
CID 4129647
N-(5-chloro-2-hydroxyphenyl)-3-[(dimethylamino)sulfonyl]benzamide
CID 1262342
N-(4-hydroxyphenyl)-3-piperidin-1-ylsulfonylbenzamide
CID 3115504
N-(2-hydroxyphenyl)-3-(4-morpholinylsulfonyl)benzamide
CID 1087707
3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-hydroxyphenyl)benzamide
CID 1087788
3-{3-[(3-Fluorophenyl)sulfamoyl]benzamido}benzoic acid
CID 1110927
4-{[(3-hydroxyphenyl)amino]sulfonyl}-N-phenylbenzamide
CID 2221592
N-(2-methoxyphenyl)-4-[(2,3,4-trifluorophenyl)sulfonylamino]benzamide
CID 2444155

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide?
The IUPAC name of 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide (CID 992247) is 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide.
What is the SMILES notation for 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide?
The canonical SMILES for 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide is O=C(Nc1ccccc1O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1.
What is the InChIKey of 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide?
The InChIKey is OICSOIZQPJLUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O4S/c20-14-8-10-15(11-9-14)22-27(25,26)16-5-3-4-13(12-16)19(24)21-17-6-1-2-7-18(17)23/h1-12,22-23H,(H,21,24).
What are the key properties of 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide?
3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide has a molecular weight of 386.40 g/mol, XLogP of 3.58, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide is sourced from PubChem (CID 992247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).