2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide

C21H19ClN2O4S — CID 55527722

IUPAC2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide
SMILESO=C(NCC(O)c1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C21H19ClN2O4S/c22-16-10-12-17(13-11-16)29(27,28)24-19-9-5-4-8-18(19)21(26)23-14-20(25)15-6-2-1-3-7-15/h1-13,20,24-25H,14H2,(H,23,26)
InChIKeyHEAAWZCANLHHQJ-UHFFFAOYSA-N
MW430.91 g/mol
LogP3.60
Rot. Bonds7

About 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide

2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide (PubChem CID 55527722) has the molecular formula C21H19ClN2O4S and a molecular weight of 430.91 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide
PubChem CID55527722
Molecular FormulaC21H19ClN2O4S
Molecular Weight430.91 g/mol
Exact Mass430.08
IUPAC Name2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide
SMILESO=C(NCC(O)c1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C21H19ClN2O4S/c22-16-10-12-17(13-11-16)29(27,28)24-19-9-5-4-8-18(19)21(26)23-14-20(25)15-6-2-1-3-7-15/h1-13,20,24-25H,14H2,(H,23,26)
InChIKeyHEAAWZCANLHHQJ-UHFFFAOYSA-N
XLogP3.60
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.91
LogP ≤ 53.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(benzenesulfonamido)-N-[2-(4-chlorophenyl)sulfanylethyl]benzamide
CID 126412818
N-butan-2-yl-2-[(4-chlorophenyl)sulfonylamino]benzamide
CID 2947064
2-(benzenesulfonamido)-N-(4-chlorophenyl)benzamide
CID 1243115
2-(benzenesulfonamido)-N-benzylbenzamide
CID 1320833
N-[4-(benzylsulfamoyl)phenyl]-2-[(4-chlorophenyl)sulfonylamino]benzamide
CID 66863129
5-(4-chlorophenyl)-N-(2-hydroxy-2-phenylethyl)-1H-pyrazole-4-carboxamide
CID 155946762
2-[[2-[(4-chlorophenyl)sulfonylamino]benzoyl]amino]benzamide
CID 1325152
2-[(4-chlorophenyl)sulfonylamino]-N,N-diethylbenzamide
CID 34838079
2-[(4-acetylphenyl)sulfonylamino]-N-(2-methylpropyl)benzamide
CID 18082666
2-[[(2R)-2-hydroxy-2-phenylethyl]carbamoyl]benzoate
CID 7189543
4-chloro-2-fluoro-N-[(2S)-2-hydroxy-2-phenylethyl]benzamide
CID 51681217
3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide
CID 133163880

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide (CID 55527722) is 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide is O=C(NCC(O)c1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide?
The InChIKey is HEAAWZCANLHHQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O4S/c22-16-10-12-17(13-11-16)29(27,28)24-19-9-5-4-8-18(19)21(26)23-14-20(25)15-6-2-1-3-7-15/h1-13,20,24-25H,14H2,(H,23,26).
What are the key properties of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide?
2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide has a molecular weight of 430.91 g/mol, XLogP of 3.60, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide is sourced from PubChem (CID 55527722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).