N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide

C20H16F2N2O3S — CID 7553514

IUPACN-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(F)cc3F)cc2)cc1
InChIInChI=1S/C20H16F2N2O3S/c1-13-2-9-17(10-3-13)28(26,27)24-16-7-4-14(5-8-16)20(25)23-19-11-6-15(21)12-18(19)22/h2-12,24H,1H3,(H,23,25)
InChIKeyCISCNRWIZJOAOZ-UHFFFAOYSA-N
MW402.42 g/mol
LogP4.33
Rot. Bonds5

About N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide

N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide (PubChem CID 7553514) has the molecular formula C20H16F2N2O3S and a molecular weight of 402.42 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
PubChem CID7553514
Molecular FormulaC20H16F2N2O3S
Molecular Weight402.42 g/mol
Exact Mass402.08
IUPAC NameN-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(F)cc3F)cc2)cc1
InChIInChI=1S/C20H16F2N2O3S/c1-13-2-9-17(10-3-13)28(26,27)24-16-7-4-14(5-8-16)20(25)23-19-11-6-15(21)12-18(19)22/h2-12,24H,1H3,(H,23,25)
InChIKeyCISCNRWIZJOAOZ-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

4-[(4-fluorophenyl)sulfamoyl]-N-(4-methylphenyl)benzamide
CID 2666297
N-[4-[(4-fluorophenyl)sulfamoyl]phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 2982317
N-(2-chloro-4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 26637724
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815
4-[(3,4-dimethylphenyl)sulfonylamino]-N-(4-fluoro-2-methylphenyl)benzamide
CID 26886474
4-tert-butyl-N-[4-[(2,4-difluorophenyl)sulfamoyl]phenyl]benzamide
CID 2730339
4-[(4-fluorophenyl)sulfamoyl]-N-(2-methoxy-5-methylphenyl)benzamide
CID 26709820
N-(2,4-difluorophenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 9164980
N-(2,4-dimethylphenyl)-4-[(3-fluorophenyl)sulfamoyl]benzamide
CID 109061734
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
N-(4-chlorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 7720348
4-[(4-chlorophenyl)sulfamoyl]-N-(4-methylphenyl)benzamide
CID 9411666

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide (CID 7553514) is N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide is Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(F)cc3F)cc2)cc1.
What is the InChIKey of N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide?
The InChIKey is CISCNRWIZJOAOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F2N2O3S/c1-13-2-9-17(10-3-13)28(26,27)24-16-7-4-14(5-8-16)20(25)23-19-11-6-15(21)12-18(19)22/h2-12,24H,1H3,(H,23,25).
What are the key properties of N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide?
N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]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 N-(2,4-difluorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 7553514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).