molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide

C19H22N2O4S — CID 158388567

IUPACmolecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1cccc(NC(=O)c2cccc(Oc3ccccc3)c2)c1.[H][H].[H][H].[H][H]
InChIInChI=1S/C19H16N2O4S.3H2/c20-26(23,24)18-11-5-7-15(13-18)21-19(22)14-6-4-10-17(12-14)25-16-8-2-1-3-9-16;;;/h1-13H,(H,21,22)(H2,20,23,24);3*1H
InChIKeyGWQVNHQFKMKMLO-UHFFFAOYSA-N
MW374.46 g/mol
LogP4.12
Rot. Bonds5

About molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide

molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide (PubChem CID 158388567) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Namemolecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide
PubChem CID158388567
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC Namemolecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1cccc(NC(=O)c2cccc(Oc3ccccc3)c2)c1.[H][H].[H][H].[H][H]
InChIInChI=1S/C19H16N2O4S.3H2/c20-26(23,24)18-11-5-7-15(13-18)21-19(22)14-6-4-10-17(12-14)25-16-8-2-1-3-9-16;;;/h1-13H,(H,21,22)(H2,20,23,24);3*1H
InChIKeyGWQVNHQFKMKMLO-UHFFFAOYSA-N
XLogP4.12
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(3-sulfamoylbenzoyl)amino]benzoic acid
CID 834338
3-ethoxy-N-[4-[(3-sulfamoylphenyl)carbamoyl]phenyl]benzamide
CID 154762615
3-[[3-[(3-phenoxyphenyl)sulfamoyl]benzoyl]amino]benzamide
CID 142738706
3-chloro-N-(3-sulfamoylphenyl)benzamide
CID 26580558
4-hydrazinyl-N-(3-sulfamoylphenyl)benzamide
CID 62237100
3-phenoxy-N-(3-sulfamoylphenyl)quinoxaline-2-carboxamide
CID 78319832
N-methyl-3-[[3-[(3-phenoxyphenyl)sulfamoyl]benzoyl]amino]benzamide
CID 142738756
3-(difluoromethyl)-N-(3-sulfamoylphenyl)benzamide
CID 175329442
N-(3-ethylphenyl)-3-phenoxybenzamide
CID 7935232
N-(4-acetamidophenyl)-3-phenoxybenzamide
CID 2483771
3-(2-phenoxyethoxy)-N-(4-sulfamoylphenyl)benzamide
CID 4954916
1-N,3-N-bis(4-phenoxyphenyl)benzene-1,3-dicarboxamide
CID 3090014

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide?
The IUPAC name of molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide (CID 158388567) is molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide.
What is the SMILES notation for molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide?
The canonical SMILES for molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide is NS(=O)(=O)c1cccc(NC(=O)c2cccc(Oc3ccccc3)c2)c1.[H][H].[H][H].[H][H].
What is the InChIKey of molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide?
The InChIKey is GWQVNHQFKMKMLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O4S.3H2/c20-26(23,24)18-11-5-7-15(13-18)21-19(22)14-6-4-10-17(12-14)25-16-8-2-1-3-9-16;;;/h1-13H,(H,21,22)(H2,20,23,24);3*1H.
What are the key properties of molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide?
molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide has a molecular weight of 374.46 g/mol, XLogP of 4.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;3-phenoxy-N-(3-sulfamoylphenyl)benzamide is sourced from PubChem (CID 158388567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).