N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide

C22H22N2O5S — CID 1289212

IUPACN-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccccc2NS(=O)(=O)c2ccc(C)cc2)c1
InChIInChI=1S/C22H22N2O5S/c1-15-8-11-17(12-9-15)30(26,27)24-19-7-5-4-6-18(19)22(25)23-20-14-16(28-2)10-13-21(20)29-3/h4-14,24H,1-3H3,(H,23,25)
InChIKeyHZJSTSZDATZJQH-UHFFFAOYSA-N
MW426.49 g/mol
LogP4.07
Rot. Bonds7

About N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide

N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide (PubChem CID 1289212) has the molecular formula C22H22N2O5S and a molecular weight of 426.49 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
PubChem CID1289212
Molecular FormulaC22H22N2O5S
Molecular Weight426.49 g/mol
Exact Mass426.12
IUPAC NameN-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccccc2NS(=O)(=O)c2ccc(C)cc2)c1
InChIInChI=1S/C22H22N2O5S/c1-15-8-11-17(12-9-15)30(26,27)24-19-7-5-4-6-18(19)22(25)23-20-14-16(28-2)10-13-21(20)29-3/h4-14,24H,1-3H3,(H,23,25)
InChIKeyHZJSTSZDATZJQH-UHFFFAOYSA-N
XLogP4.07
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.49
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(benzenesulfonamido)-N-(2,5-dimethoxyphenyl)benzamide
CID 4233924
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
CID 71903202
N-(2,5-dimethoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 41455271
2-[(3,4-difluorophenyl)sulfonylamino]-N-(2,4-dimethoxyphenyl)benzamide
CID 2374439
methyl 2-methyl-3-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate
CID 2980517
2-[(3,4-dimethylphenyl)sulfonylamino]-N-(4-methoxyphenyl)benzamide
CID 18229347
N-(2,5-dimethoxyphenyl)-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 95254693
2-[(4-carbamoylphenyl)sulfonylamino]-N-(2-methoxyphenyl)benzamide
CID 18100692
2-chloro-N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18892982
2-[(4-methoxyphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 7541926
N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]acetamide
CID 21383211
2-[(6-chloro-3-pyridinyl)sulfonylamino]-N-(2,4-dimethoxyphenyl)benzamide
CID 2683748

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide (CID 1289212) is N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide is COc1ccc(OC)c(NC(=O)c2ccccc2NS(=O)(=O)c2ccc(C)cc2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide?
The InChIKey is HZJSTSZDATZJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O5S/c1-15-8-11-17(12-9-15)30(26,27)24-19-7-5-4-6-18(19)22(25)23-20-14-16(28-2)10-13-21(20)29-3/h4-14,24H,1-3H3,(H,23,25).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide?
N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide has a molecular weight of 426.49 g/mol, XLogP of 4.07, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 1289212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).