2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide

C20H16F2N2O3S — CID 60621514

IUPAC2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2ccccc2NS(=O)(=O)c2cccc(F)c2F)c1
InChIInChI=1S/C20H16F2N2O3S/c1-13-6-4-7-14(12-13)23-20(25)15-8-2-3-10-17(15)24-28(26,27)18-11-5-9-16(21)19(18)22/h2-12,24H,1H3,(H,23,25)
InChIKeyQORVRBPOZUUWIN-UHFFFAOYSA-N
MW402.42 g/mol
LogP4.33
Rot. Bonds5

About 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide

2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide (PubChem CID 60621514) has the molecular formula C20H16F2N2O3S and a molecular weight of 402.42 g/mol. Its IUPAC name is 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide
PubChem CID60621514
Molecular FormulaC20H16F2N2O3S
Molecular Weight402.42 g/mol
Exact Mass402.08
IUPAC Name2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2ccccc2NS(=O)(=O)c2cccc(F)c2F)c1
InChIInChI=1S/C20H16F2N2O3S/c1-13-6-4-7-14(12-13)23-20(25)15-8-2-3-10-17(15)24-28(26,27)18-11-5-9-16(21)19(18)22/h2-12,24H,1H3,(H,23,25)
InChIKeyQORVRBPOZUUWIN-UHFFFAOYSA-N
XLogP4.33
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.42
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-carbamoylphenyl)sulfonylamino]-N-(3-methylphenyl)benzamide
CID 46644069
3-[(2-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)benzamide
CID 26537969
N-(3-methylphenyl)-2-[(2-oxo-1H-benzo[cd]indol-6-yl)sulfonylamino]benzamide
CID 55662988
N-(3-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 2332033
N-(3-methylphenyl)-2-(propylamino)benzamide
CID 62171242
N-(2-acetylphenyl)-2,3,4-trifluorobenzenesulfonamide
CID 2442571
2-[(2-chlorobenzoyl)amino]-N-(3-methylphenyl)benzamide
CID 29448368
4-methyl-N-(3-methylphenyl)-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 3443148
2-(2-fluoroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 23632686
N-(3,5-dichlorophenyl)-2-[(2,5-dimethylphenyl)sulfonylamino]benzamide
CID 2333532
2-[[4-(tert-butylsulfamoyl)benzoyl]amino]-N-(3-methylphenyl)benzamide
CID 55499981
2,5-difluoro-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]benzamide
CID 30489963

Frequently Asked Questions

What is the IUPAC name of 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide?
The IUPAC name of 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide (CID 60621514) is 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide?
The canonical SMILES for 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide is Cc1cccc(NC(=O)c2ccccc2NS(=O)(=O)c2cccc(F)c2F)c1.
What is the InChIKey of 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide?
The InChIKey is QORVRBPOZUUWIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F2N2O3S/c1-13-6-4-7-14(12-13)23-20(25)15-8-2-3-10-17(15)24-28(26,27)18-11-5-9-16(21)19(18)22/h2-12,24H,1H3,(H,23,25).
What are the key properties of 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide?
2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide has a molecular weight of 402.42 g/mol, XLogP of 4.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,3-difluorophenyl)sulfonylamino]-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 60621514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).