2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide

C20H18N2O4S — CID 24854768

IUPAC2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1cccc(NC(=O)c2ccccc2COc2ccccc2)c1
InChIInChI=1S/C20H18N2O4S/c21-27(24,25)18-11-6-8-16(13-18)22-20(23)19-12-5-4-7-15(19)14-26-17-9-2-1-3-10-17/h1-13H,14H2,(H,22,23)(H2,21,24,25)
InChIKeyXHVHULYLIFZNIS-UHFFFAOYSA-N
MW382.44 g/mol
LogP3.17
Rot. Bonds6

About 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide

2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide (PubChem CID 24854768) has the molecular formula C20H18N2O4S and a molecular weight of 382.44 g/mol. Its IUPAC name is 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide
PubChem CID24854768
Molecular FormulaC20H18N2O4S
Molecular Weight382.44 g/mol
Exact Mass382.10
IUPAC Name2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1cccc(NC(=O)c2ccccc2COc2ccccc2)c1
InChIInChI=1S/C20H18N2O4S/c21-27(24,25)18-11-6-8-16(13-18)22-20(23)19-12-5-4-7-15(19)14-26-17-9-2-1-3-10-17/h1-13H,14H2,(H,22,23)(H2,21,24,25)
InChIKeyXHVHULYLIFZNIS-UHFFFAOYSA-N
XLogP3.17
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(phenoxymethyl)-N-(3-sulfamoylphenyl)furan-2-carboxamide
CID 9413056
N-(3-ethynylphenyl)-2-(phenoxymethyl)benzamide
CID 24676287
2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 24676056
2,5-dihydroxy-N-(3-sulfamoylphenyl)benzamide
CID 107722283
2-methyl-N-(3-sulfamoylphenyl)pyridine-3-carboxamide
CID 78950909
molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide
CID 158388567
N-(3-chloro-4-methoxyphenyl)-2-(phenoxymethyl)benzamide
CID 17428367
1-methyl-1-(2-phenoxyethyl)-3-(3-sulfamoylphenyl)urea
CID 38147908
2-amino-3-chloro-N-(3-sulfamoylphenyl)benzamide
CID 115539982
2,4-dibromo-N-(3-sulfamoylphenyl)benzamide
CID 103885203
3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide
CID 105064331
2-(phenoxymethyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]benzamide
CID 24645763

Frequently Asked Questions

What is the IUPAC name of 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide?
The IUPAC name of 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide (CID 24854768) is 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide.
What is the SMILES notation for 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide?
The canonical SMILES for 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide is NS(=O)(=O)c1cccc(NC(=O)c2ccccc2COc2ccccc2)c1.
What is the InChIKey of 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide?
The InChIKey is XHVHULYLIFZNIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O4S/c21-27(24,25)18-11-6-8-16(13-18)22-20(23)19-12-5-4-7-15(19)14-26-17-9-2-1-3-10-17/h1-13H,14H2,(H,22,23)(H2,21,24,25).
What are the key properties of 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide?
2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide has a molecular weight of 382.44 g/mol, XLogP of 3.17, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide is sourced from PubChem (CID 24854768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).