2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide

C21H20N2O4S — CID 24676056

IUPAC2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide
SMILESNS(=O)(=O)Cc1ccc(NC(=O)c2ccccc2COc2ccccc2)cc1
InChIInChI=1S/C21H20N2O4S/c22-28(25,26)15-16-10-12-18(13-11-16)23-21(24)20-9-5-4-6-17(20)14-27-19-7-2-1-3-8-19/h1-13H,14-15H2,(H,23,24)(H2,22,25,26)
InChIKeyWSFHUGLNCBNQCX-UHFFFAOYSA-N
MW396.47 g/mol
LogP3.31
Rot. Bonds7

About 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide

2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide (PubChem CID 24676056) has the molecular formula C21H20N2O4S and a molecular weight of 396.47 g/mol. Its IUPAC name is 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide.

Molecular Properties

Compound Name2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide
PubChem CID24676056
Molecular FormulaC21H20N2O4S
Molecular Weight396.47 g/mol
Exact Mass396.11
IUPAC Name2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide
SMILESNS(=O)(=O)Cc1ccc(NC(=O)c2ccccc2COc2ccccc2)cc1
InChIInChI=1S/C21H20N2O4S/c22-28(25,26)15-16-10-12-18(13-11-16)23-21(24)20-9-5-4-6-17(20)14-27-19-7-2-1-3-8-19/h1-13H,14-15H2,(H,23,24)(H2,22,25,26)
InChIKeyWSFHUGLNCBNQCX-UHFFFAOYSA-N
XLogP3.31
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.47
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(phenoxymethyl)-N-(3-sulfamoylphenyl)benzamide
CID 24854768
2-anilino-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 55616235
2-methyl-N-[4-(sulfamoylmethyl)phenyl]pyridine-3-carboxamide
CID 78950943
2-(difluoromethoxy)-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 39977055
2-propylsulfonyl-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 55678185
2-(phenoxymethyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide
CID 55566637
benzyl 2-[[2-(phenoxymethyl)benzoyl]amino]acetate
CID 32982202
N-(3-ethynylphenyl)-2-(phenoxymethyl)benzamide
CID 24676287
N-(3-chloro-4-methoxyphenyl)-2-(phenoxymethyl)benzamide
CID 17428367
N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]-2-(phenoxymethyl)benzamide
CID 29357190
N-[4-(phenoxymethyl)phenyl]benzamide
CID 141092226
2-(5-phenyl-1,3-oxazol-2-yl)-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 24676064

Frequently Asked Questions

What is the IUPAC name of 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide?
The IUPAC name of 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide (CID 24676056) is 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide.
What is the SMILES notation for 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide?
The canonical SMILES for 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide is NS(=O)(=O)Cc1ccc(NC(=O)c2ccccc2COc2ccccc2)cc1.
What is the InChIKey of 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide?
The InChIKey is WSFHUGLNCBNQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O4S/c22-28(25,26)15-16-10-12-18(13-11-16)23-21(24)20-9-5-4-6-17(20)14-27-19-7-2-1-3-8-19/h1-13H,14-15H2,(H,23,24)(H2,22,25,26).
What are the key properties of 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide?
2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide has a molecular weight of 396.47 g/mol, XLogP of 3.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phenoxymethyl)-N-[4-(sulfamoylmethyl)phenyl]benzamide is sourced from PubChem (CID 24676056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).